6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide

C15H16ClN3O — CID 78990903

IUPAC6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide
SMILESCc1ccccc1CCNC(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C15H16ClN3O/c1-10-4-2-3-5-11(10)6-7-18-15(20)12-8-13(16)14(17)19-9-12/h2-5,8-9H,6-7H2,1H3,(H2,17,19)(H,18,20)
InChIKeyJLGLDOPZQVRSNY-UHFFFAOYSA-N
MW289.77 g/mol
LogP2.60
Rot. Bonds4

About 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide

6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide (PubChem CID 78990903) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide
PubChem CID78990903
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC Name6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide
SMILESCc1ccccc1CCNC(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C15H16ClN3O/c1-10-4-2-3-5-11(10)6-7-18-15(20)12-8-13(16)14(17)19-9-12/h2-5,8-9H,6-7H2,1H3,(H2,17,19)(H,18,20)
InChIKeyJLGLDOPZQVRSNY-UHFFFAOYSA-N
XLogP2.60
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-5-chloro-N-(2-phenylethyl)pyridine-3-carboxamide
CID 55043054
3,4-dichloro-N-[2-(2-methylphenyl)ethyl]benzamide
CID 27837884
6-amino-5-chloro-N-[(2-fluorophenyl)methyl]pyridine-3-carboxamide
CID 55043681
6-amino-5-chloro-N-propylpyridine-3-carboxamide
CID 62156037
5-hydroxy-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 78953956
6-amino-5-chloro-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
CID 55041683
6-amino-N-benzyl-5-chloropyridine-3-carboxamide
CID 62153073
2-amino-3-ethyl-N-[2-(2-methylphenyl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 70723115
6-amino-5-chloro-N-[2-[cyclopropyl(methyl)amino]ethyl]pyridine-3-carboxamide
CID 62728599
6-amino-5-chloro-N-(2-phenylpropyl)pyridine-3-carboxamide
CID 115601161
3-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-4-carboxamide
CID 79079687
3-bromo-5-chloro-N-[2-(2-methylphenyl)ethyl]benzamide
CID 107952730

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide (CID 78990903) is 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide is Cc1ccccc1CCNC(=O)c1cnc(N)c(Cl)c1.
What is the InChIKey of 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is JLGLDOPZQVRSNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-10-4-2-3-5-11(10)6-7-18-15(20)12-8-13(16)14(17)19-9-12/h2-5,8-9H,6-7H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide?
6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 289.77 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 78990903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).