2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide
TL;DR: 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide (CAS 1042694-42-7) is a chemical compound with molecular formula C22H30N2O2 and molecular weight 354.23074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1-anilino-3-methyl-1-oxobutan-2-yl)adamantane-1-carboxamide
Also Known As: VU0510786-1, 2-[(adamantan-1-yl)formamido]-3-methyl-N-phenylbutanamide, 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide, F3156-0010, N-(1-anilino-3-methyl-1-oxobutan-2-yl)adamantane-1-carboxamide
Technical Specifications
| Molecular Formula | C22H30N2O2 |
| Molecular Weight | 354.23074 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.23074 Da |
| Heavy Atoms | 26 |
| Complexity | 509.0 |
| SMILES | CC(C)C(C(=O)NC1=CC=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3 |
| InChIKey | MTNWMDSYESUYRX-UHFFFAOYSA-N |
Chemical Property Profile of 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide
Property Insights of 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide
The XLogP value of 4.4 indicates that 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide?
The CAS number of 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide is 1042694-42-7.
What is the molecular formula of 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide?
The molecular formula of 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide is C22H30N2O2.
What is the molecular weight of 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide?
The molecular weight of 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide is 354.23074 g/mol.
Where can I buy 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide?
You can request a quote for 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide?
Yes, CoreyChem provides custom synthesis services for 2-(adamantanylcarbonylamino)-3-methyl-N-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.