N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide
TL;DR: N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide (CAS 14559-43-4) is a chemical compound with molecular formula C9H13N5O3 and molecular weight 239.10184 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide
Also Known As: N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide, N-(3-Amino-3-iminopropyl)-1-methyl-4-nitro-1H-pyrrole-2-carboxamide, Pyrrole-2-carboxamide, N-(2-amidinoethyl)-1-methyl-4-nitro-, 1H-Pyrrole-2-carboxamide, N-(3-amino-3-iminopropyl)-1-methyl-4-nitro-, N-(2-carbamimidoylethyl)-1-methyl-4-nitro-1H-pyrrole-2-carboxamide
Technical Specifications
| Molecular Formula | C9H13N5O3 |
| Molecular Weight | 239.10184 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.10184 Da |
| Heavy Atoms | 17 |
| Complexity | 327.0 |
| SMILES | CN1C=C(C=C1C(=O)NCCC(=N)N)[N+](=O)[O-] |
| InChIKey | KIQYRLXDGHDTDK-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide
Property Insights of N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide
The XLogP value of -1.0 indicates that N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide. Following Lipinski's Rule of Five, N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide has 3 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 N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide?
The CAS number of N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide is 14559-43-4.
What is the molecular formula of N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide?
The molecular formula of N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide is C9H13N5O3.
What is the molecular weight of N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide?
The molecular weight of N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide is 239.10184 g/mol.
Where can I buy N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide?
You can request a quote for N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide?
Yes, CoreyChem provides custom synthesis services for N-(3-amino-3-iminopropyl)-1-methyl-4-nitropyrrole-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.