N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide

C15H18N4O — CID 117080375

IUPACN-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
SMILESCCCNC(=O)c1cccc(NCc2cccnc2)n1
InChIInChI=1S/C15H18N4O/c1-2-8-17-15(20)13-6-3-7-14(19-13)18-11-12-5-4-9-16-10-12/h3-7,9-10H,2,8,11H2,1H3,(H,17,20)(H,18,19)
InChIKeyXJXUGSXQWGLNAE-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.23
Rot. Bonds6

About N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide

N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide (PubChem CID 117080375) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
PubChem CID117080375
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
SMILESCCCNC(=O)c1cccc(NCc2cccnc2)n1
InChIInChI=1S/C15H18N4O/c1-2-8-17-15(20)13-6-3-7-14(19-13)18-11-12-5-4-9-16-10-12/h3-7,9-10H,2,8,11H2,1H3,(H,17,20)(H,18,19)
InChIKeyXJXUGSXQWGLNAE-UHFFFAOYSA-N
XLogP2.23
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(propylamino)-N-(2-pyridin-3-ylethyl)pyridine-2-carboxamide
CID 62240151
2-N-[2-(dimethylamino)ethyl]-6-N-(pyridin-3-ylmethyl)pyridine-2,6-dicarboxamide
CID 109096293
N-[(3-methyl-4-pyridinyl)methyl]-6-(propylamino)pyridine-2-carboxamide
CID 114701818
6-(1,3-benzodioxol-5-ylmethylamino)-N-propylpyridine-2-carboxamide
CID 117090083
6-N-[(3Z)-4-(propylamino)penta-1,3-dien-2-yl]-2-N-(pyridin-3-ylmethyl)pyridine-2,6-diamine
CID 142160122
2-N-(3-methoxypropyl)-6-N-(pyridin-3-ylmethyl)pyridine-2,6-dicarboxamide
CID 109095843
6-(pyridin-3-ylmethylcarbamoyl)pyridine-2-carboxylic acid
CID 43558442
N-propyl-6-[6-(propylcarbamoyl)-2-pyridinyl]pyridine-2-carboxamide
CID 10980324
N-pentyl-2-phenyl-6-(pyridin-3-ylmethylamino)pyrimidine-4-carboxamide
CID 112854090
N-pentyl-5-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109191345
6-methyl-N-pentyl-2-(pyridin-3-ylmethylamino)pyrimidine-4-carboxamide
CID 109329888
6-N-(2,6-diethylphenyl)-2-N-(pyridin-3-ylmethyl)pyridine-2,6-dicarboxamide
CID 109098267

Frequently Asked Questions

What is the IUPAC name of N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide?
The IUPAC name of N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide (CID 117080375) is N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide is CCCNC(=O)c1cccc(NCc2cccnc2)n1.
What is the InChIKey of N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide?
The InChIKey is XJXUGSXQWGLNAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-2-8-17-15(20)13-6-3-7-14(19-13)18-11-12-5-4-9-16-10-12/h3-7,9-10H,2,8,11H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide?
N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-6-(pyridin-3-ylmethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 117080375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).