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4-Methyl-2-(2-oxopropanoylamino)pentanoic acid structure
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4-Methyl-2-(2-oxopropanoylamino)pentanoic acid

TL;DR: 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid (CAS 101914-46-9) is a chemical compound with molecular formula C9H15NO4 and molecular weight 201.10011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-methyl-2-(2-oxopropanoylamino)pentanoic acid

Also Known As: Leucine, N-pyruvoyl- (6CI), 4-methyl-2-(2-oxopropanoylamino)pentanoic Acid

CAS Number
101914-46-9
Molecular Formula
C9H15NO4
Molecular Weight
201.10011 g/mol
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Technical Specifications

Molecular FormulaC9H15NO4
Molecular Weight201.10011 g/mol
XLogP0.7
Topological Polar Surface Area (TPSA)83.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds5
Exact Mass201.10011 Da
Heavy Atoms14
Complexity247.0
SMILESCC(C)CC(C(=O)O)NC(=O)C(=O)C
InChIKeyNLCDEINRJVCKTG-UHFFFAOYSA-N

Chemical Property Profile of 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid

XLogP
0.7
TPSA (Topological Polar Surface Area)
83.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
14
Complexity
247.0
Exact Mass
201.10011
Monoisotopic Mass
201.10011
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid

The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid. Following Lipinski's Rule of Five, 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid?

The CAS number of 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid is 101914-46-9.

What is the molecular formula of 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid?

The molecular formula of 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid is C9H15NO4.

What is the molecular weight of 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid?

The molecular weight of 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid is 201.10011 g/mol.

Where can I buy 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid?

You can request a quote for 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid?

Yes, CoreyChem provides custom synthesis services for 4-Methyl-2-(2-oxopropanoylamino)pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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