2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide

C15H17N3O — CID 62161798

IUPAC2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide
SMILESCc1cc(C)cc(N(C)C(=O)c2cccnc2N)c1
InChIInChI=1S/C15H17N3O/c1-10-7-11(2)9-12(8-10)18(3)15(19)13-5-4-6-17-14(13)16/h4-9H,1-3H3,(H2,16,17)
InChIKeyNJWXHAQUEGTEOI-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.56
Rot. Bonds2

About 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide

2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide (PubChem CID 62161798) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide
PubChem CID62161798
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide
SMILESCc1cc(C)cc(N(C)C(=O)c2cccnc2N)c1
InChIInChI=1S/C15H17N3O/c1-10-7-11(2)9-12(8-10)18(3)15(19)13-5-4-6-17-14(13)16/h4-9H,1-3H3,(H2,16,17)
InChIKeyNJWXHAQUEGTEOI-UHFFFAOYSA-N
XLogP2.56
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3,5-dimethylphenyl)-3-fluoro-N-methylpyridine-4-carboxamide
CID 105385601
6-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-2-carboxamide
CID 62240518
2-amino-N-(3,5-dimethylphenyl)-5-fluoro-N-methylbenzamide
CID 62002165
2-amino-5-bromo-N-methyl-N-(3-methylphenyl)pyridine-3-carboxamide
CID 62160905
2-fluoro-N-(3-fluorophenyl)-N-methylpyridine-3-carboxamide
CID 114037685
2-amino-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-carboxamide
CID 63961873
2-amino-N',N'-dimethylpyridine-3-carbohydrazide
CID 83024659
3-[(N,3,5-trimethylanilino)methyl]pyridin-2-amine
CID 62465010
N-(3,5-dimethylphenyl)-2-hydrazinyl-N,5-dimethylbenzamide
CID 62512821
2-amino-N-methyl-N-(3-methylbutyl)pyridine-3-carboxamide
CID 62185668
2-amino-N-methyl-N-(4-methylpentan-2-yl)pyridine-3-carboxamide
CID 62058999
2-amino-N-[(5-bromothiophen-3-yl)methyl]-N-methylpyridine-3-carboxamide
CID 62186650

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide?
The IUPAC name of 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide (CID 62161798) is 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide is Cc1cc(C)cc(N(C)C(=O)c2cccnc2N)c1.
What is the InChIKey of 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide?
The InChIKey is NJWXHAQUEGTEOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-10-7-11(2)9-12(8-10)18(3)15(19)13-5-4-6-17-14(13)16/h4-9H,1-3H3,(H2,16,17).
What are the key properties of 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide?
2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-dimethylphenyl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 62161798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).