4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide

C15H16ClN3O — CID 81227477

IUPAC4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCCN(Cc1ccncc1)C(=O)c1cnc(C)cc1Cl
InChIInChI=1S/C15H16ClN3O/c1-3-19(10-12-4-6-17-7-5-12)15(20)13-9-18-11(2)8-14(13)16/h4-9H,3,10H2,1-2H3
InChIKeyCKBOLMFYMJQGTM-UHFFFAOYSA-N
MW289.77 g/mol
LogP3.10
Rot. Bonds4

About 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide

4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide (PubChem CID 81227477) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
PubChem CID81227477
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC Name4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCCN(Cc1ccncc1)C(=O)c1cnc(C)cc1Cl
InChIInChI=1S/C15H16ClN3O/c1-3-19(10-12-4-6-17-7-5-12)15(20)13-9-18-11(2)8-14(13)16/h4-9H,3,10H2,1-2H3
InChIKeyCKBOLMFYMJQGTM-UHFFFAOYSA-N
XLogP3.10
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-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

5-chloro-N-ethyl-2-(methylamino)-N-(pyridin-4-ylmethyl)pyridine-4-carboxamide
CID 114922658
4-chloro-N-[3-(dimethylamino)propyl]-N-ethyl-6-methylpyridine-3-carboxamide
CID 102978950
4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide
CID 81225000
N,N-dibutyl-4-chloro-6-methylpyridine-3-carboxamide
CID 81224997
5-chloro-N-ethyl-6-(methylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 62180547
4-[ethyl(pyridin-4-ylmethyl)amino]-6-methylpyridine-3-carboxylic acid
CID 81233499
3-chloro-N-[(3,4-difluorophenyl)methyl]-N-ethylpyridine-4-carboxamide
CID 66483932
N-ethyl-6-(methylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 62180545
4-chloro-6-methyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 81226727
4-amino-N-ethyl-N-(pyridin-4-ylmethyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 57218772
4-chloro-N-ethyl-6-methyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 81226969
4-chloro-6-methyl-N-propan-2-yl-N-propylpyridine-3-carboxamide
CID 81225563

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide (CID 81227477) is 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide is CCN(Cc1ccncc1)C(=O)c1cnc(C)cc1Cl.
What is the InChIKey of 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The InChIKey is CKBOLMFYMJQGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-3-19(10-12-4-6-17-7-5-12)15(20)13-9-18-11(2)8-14(13)16/h4-9H,3,10H2,1-2H3.
What are the key properties of 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide has a molecular weight of 289.77 g/mol, XLogP of 3.10, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81227477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).