3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide

C15H17ClN4O — CID 62168209

IUPAC3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)N(C)Cc2ccccn2)n1
InChIInChI=1S/C15H17ClN4O/c1-3-17-13-8-7-12(16)14(19-13)15(21)20(2)10-11-6-4-5-9-18-11/h4-9H,3,10H2,1-2H3,(H,17,19)
InChIKeyIBOHNSFDHWZGSZ-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.83
Rot. Bonds5

About 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide

3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 62168209) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
PubChem CID62168209
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)N(C)Cc2ccccn2)n1
InChIInChI=1S/C15H17ClN4O/c1-3-17-13-8-7-12(16)14(19-13)15(21)20(2)10-11-6-4-5-9-18-11/h4-9H,3,10H2,1-2H3,(H,17,19)
InChIKeyIBOHNSFDHWZGSZ-UHFFFAOYSA-N
XLogP2.83
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-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

3-chloro-6-(3,5-dimethylpyrazol-1-yl)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 86839956
3-chloro-N-(2-ethoxyethyl)-6-(ethylamino)-N-methylpyridine-2-carboxamide
CID 81074655
3-chloro-6-(methylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 62166943
N-ethyl-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
CID 79243794
3-chloro-6-(ethylamino)-N-propan-2-yl-N-propylpyridine-2-carboxamide
CID 62169311
3-chloro-N-[(2-chlorophenyl)methyl]-6-hydrazinyl-N-methylpyridine-2-carboxamide
CID 62241888
3-chloro-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-6-(ethylamino)pyridine-2-carboxamide
CID 103191078
5-chloro-N-methyl-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 62167870
3-chloro-N-ethyl-6-(ethylamino)-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 62179575
5-chloro-2-hydroxy-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 43565718
4-chloro-2-fluoro-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 86824171
N-butan-2-yl-N-butyl-3-chloro-6-(ethylamino)pyridine-2-carboxamide
CID 62176971

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide (CID 62168209) is 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide is CCNc1ccc(Cl)c(C(=O)N(C)Cc2ccccn2)n1.
What is the InChIKey of 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is IBOHNSFDHWZGSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-3-17-13-8-7-12(16)14(19-13)15(21)20(2)10-11-6-4-5-9-18-11/h4-9H,3,10H2,1-2H3,(H,17,19).
What are the key properties of 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide?
3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(ethylamino)-N-methyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62168209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).