5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide

C16H19N3O — CID 61039486

IUPAC5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C16H19N3O/c1-10(2)13-6-4-5-7-15(13)19-16(20)14-8-12(17)9-18-11(14)3/h4-10H,17H2,1-3H3,(H,19,20)
InChIKeyMYQVFPXRAXKCIV-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.35
Rot. Bonds3

About 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide

5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide (PubChem CID 61039486) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
PubChem CID61039486
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C16H19N3O/c1-10(2)13-6-4-5-7-15(13)19-16(20)14-8-12(17)9-18-11(14)3/h4-10H,17H2,1-3H3,(H,19,20)
InChIKeyMYQVFPXRAXKCIV-UHFFFAOYSA-N
XLogP3.35
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-2-methyl-N-(2-methylsulfanylphenyl)pyridine-3-carboxamide
CID 61117272
5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide
CID 54913836
5-amino-2-methyl-N-(2-methylsulfonylphenyl)pyridine-3-carboxamide
CID 61112376
5-amino-2-methyl-N-[1-(2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 61118673
5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
CID 54917147
5-amino-2-methyl-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 61040068
5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide
CID 61117008
2,3-dimethyl-N-(2-propan-2-ylphenyl)pyridine-4-carboxamide
CID 110858100
5-amino-2-(dimethylamino)-N-(2-propan-2-ylphenyl)benzamide
CID 91683062
3,5-diamino-N-(2-propan-2-ylphenyl)benzamide
CID 61092144
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

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide (CID 61039486) is 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide is Cc1ncc(N)cc1C(=O)Nc1ccccc1C(C)C.
What is the InChIKey of 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The InChIKey is MYQVFPXRAXKCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-10(2)13-6-4-5-7-15(13)19-16(20)14-8-12(17)9-18-11(14)3/h4-10H,17H2,1-3H3,(H,19,20).
What are the key properties of 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 3.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 61039486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).