5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide

C14H14ClN3O — CID 54917147

IUPAC5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C14H14ClN3O/c1-8-12(15)4-3-5-13(8)18-14(19)11-6-10(16)7-17-9(11)2/h3-7H,16H2,1-2H3,(H,18,19)
InChIKeyCKJOAYXBWPHONU-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.19
Rot. Bonds2

About 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide

5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide (PubChem CID 54917147) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
PubChem CID54917147
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC Name5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C14H14ClN3O/c1-8-12(15)4-3-5-13(8)18-14(19)11-6-10(16)7-17-9(11)2/h3-7H,16H2,1-2H3,(H,18,19)
InChIKeyCKJOAYXBWPHONU-UHFFFAOYSA-N
XLogP3.19
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-2-methyl-N-(2-methylsulfonylphenyl)pyridine-3-carboxamide
CID 61112376
5-amino-2-methyl-N-(2-methylsulfanylphenyl)pyridine-3-carboxamide
CID 61117272
2-amino-5-bromo-N-(3-chloro-2-methylphenyl)pyridine-3-carboxamide
CID 55042996
5-amino-N-(4-chloro-2-fluorophenyl)-2-methylpyridine-3-carboxamide
CID 61111163
5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 61039486
5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide
CID 54913836
5-amino-2-(3-chloro-2-methylanilino)pyridine-3-carboxylic acid
CID 114046976
3-amino-N-(3-chloro-2-methylphenyl)pyridine-4-carboxamide
CID 110859044
5-amino-2-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 54917395
5-amino-N-(2-fluoro-5-methylphenyl)-2-methylpyridine-3-carboxamide
CID 54916911
5-amino-N-(2,5-dibromophenyl)-2-methylpyridine-3-carboxamide
CID 61466356
N-(3-chloro-2-methylphenyl)-2,5-dimethylthiophene-3-carboxamide
CID 29203485

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide?
The IUPAC name of 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide (CID 54917147) is 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide?
The canonical SMILES for 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide is Cc1ncc(N)cc1C(=O)Nc1cccc(Cl)c1C.
What is the InChIKey of 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide?
The InChIKey is CKJOAYXBWPHONU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O/c1-8-12(15)4-3-5-13(8)18-14(19)11-6-10(16)7-17-9(11)2/h3-7H,16H2,1-2H3,(H,18,19).
What are the key properties of 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide?
5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide has a molecular weight of 275.74 g/mol, XLogP of 3.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 54917147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).