N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide

C14H14ClN3O — CID 81233976

IUPACN-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)Nc1ccc(C)c(Cl)c1
InChIInChI=1S/C14H14ClN3O/c1-9-3-4-10(7-12(9)15)18-14(19)11-8-17-6-5-13(11)16-2/h3-8H,1-2H3,(H,16,17)(H,18,19)
InChIKeyJHICZVXGZQZCLY-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.34
Rot. Bonds3

About N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide

N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide (PubChem CID 81233976) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide
PubChem CID81233976
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC NameN-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)Nc1ccc(C)c(Cl)c1
InChIInChI=1S/C14H14ClN3O/c1-9-3-4-10(7-12(9)15)18-14(19)11-8-17-6-5-13(11)16-2/h3-8H,1-2H3,(H,16,17)(H,18,19)
InChIKeyJHICZVXGZQZCLY-UHFFFAOYSA-N
XLogP3.34
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dichloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide
CID 104728161
4-(3-chloro-4-methylanilino)pyridine-3-carboxylic acid
CID 81232618
N-(3-chloro-4-methylphenyl)-2-methyl-1,6-naphthyridine-3-carboxamide
CID 110859285
4-chloro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
CID 107701234
N-(3-chloro-2-methylphenyl)-4-(methylamino)pyridine-3-carboxamide
CID 81234663
N-(3-chloro-4-methylphenyl)pyridine-4-carboxamide;hydrochloride
CID 110756427
N-(4-bromo-3-fluorophenyl)-4-(methylamino)pyridine-3-carboxamide
CID 81245752
5-acetamido-2-chloro-N-(3-chloro-4-methylphenyl)benzamide
CID 885622
N-(4-chloro-3-fluorophenyl)-3-(methylamino)pyridine-4-carboxamide
CID 105069465
N-(3-chloro-4-fluorophenyl)-3-methylpyridine-4-carboxamide
CID 110859368
N-(4-fluoro-3-methoxyphenyl)-4-(methylamino)pyridine-3-carboxamide
CID 114840716
4-(methylamino)-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 81242635

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide (CID 81233976) is N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide is CNc1ccncc1C(=O)Nc1ccc(C)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide?
The InChIKey is JHICZVXGZQZCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O/c1-9-3-4-10(7-12(9)15)18-14(19)11-8-17-6-5-13(11)16-2/h3-8H,1-2H3,(H,16,17)(H,18,19).
What are the key properties of N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide?
N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide has a molecular weight of 275.74 g/mol, XLogP of 3.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81233976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).