4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide

C15H18N4O — CID 62185886

IUPAC4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)NCc2cccnc2)c1
InChIInChI=1S/C15H18N4O/c1-2-6-17-13-5-8-18-14(9-13)15(20)19-11-12-4-3-7-16-10-12/h3-5,7-10H,2,6,11H2,1H3,(H,17,18)(H,19,20)
InChIKeyZLOFQTGJGQZJLR-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.23
Rot. Bonds6

About 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide

4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide (PubChem CID 62185886) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
PubChem CID62185886
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)NCc2cccnc2)c1
InChIInChI=1S/C15H18N4O/c1-2-6-17-13-5-8-18-14(9-13)15(20)19-11-12-4-3-7-16-10-12/h3-5,7-10H,2,6,11H2,1H3,(H,17,18)(H,19,20)
InChIKeyZLOFQTGJGQZJLR-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 4-(propylamino)-N-(pyridin-3-ylmethyl)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

N-[(4-fluorophenyl)methyl]-4-(propylamino)pyridine-2-carboxamide
CID 62167261
4-(2-methylanilino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109212998
4-(3,4-dichloroanilino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109213080
N-(pyridin-3-ylmethyl)-4-[4-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109213049
4-chloro-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 25345003
N-benzyl-4-(ethylamino)pyridine-2-carboxamide
CID 55042680
4-(3,4-dimethoxyanilino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109213046
N-phenyl-4-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109213139
N-(4-fluorophenyl)-4-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109213164
5-(ethylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 104639627
methyl 4-(pyridin-3-ylmethylamino)pyridine-2-carboxylate
CID 66008856
4-(4-propan-2-yloxyanilino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109213043

Frequently Asked Questions

What is the IUPAC name of 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide (CID 62185886) is 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide is CCCNc1ccnc(C(=O)NCc2cccnc2)c1.
What is the InChIKey of 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide?
The InChIKey is ZLOFQTGJGQZJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-2-6-17-13-5-8-18-14(9-13)15(20)19-11-12-4-3-7-16-10-12/h3-5,7-10H,2,6,11H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide?
4-(propylamino)-N-(pyridin-3-ylmethyl)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 4-(propylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62185886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).