N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide

C14H15N3O — CID 16781532

IUPACN-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2cc(N)ccc2C)n1
InChIInChI=1S/C14H15N3O/c1-9-6-7-11(15)8-13(9)17-14(18)12-5-3-4-10(2)16-12/h3-8H,15H2,1-2H3,(H,17,18)
InChIKeyKXRDLGMDMCNCOQ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.53
Rot. Bonds2

About N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide

N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide (PubChem CID 16781532) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide
PubChem CID16781532
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2cc(N)ccc2C)n1
InChIInChI=1S/C14H15N3O/c1-9-6-7-11(15)8-13(9)17-14(18)12-5-3-4-10(2)16-12/h3-8H,15H2,1-2H3,(H,17,18)
InChIKeyKXRDLGMDMCNCOQ-UHFFFAOYSA-N
XLogP2.53
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-amino-2-chlorophenyl)-6-methylpyridine-2-carboxamide
CID 16785445
N-(5-amino-2-methoxyphenyl)-6-methylpyridine-2-carboxamide
CID 16788518
methyl 4-methyl-3-[(6-methylpyridine-2-carbonyl)amino]benzoate
CID 32642709
N-(4-aminophenyl)-6-methylpyridine-2-carboxamide
CID 16784436
N-(5-bromo-4-fluoro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 103274644
N-(2-iodophenyl)-6-methylpyridine-2-carboxamide
CID 31700169
6-[(2,5-dimethylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43558433
N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide
CID 60727615
N-(3-chloro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 31759188
N-(5-amino-2-methylphenyl)naphthalene-2-carboxamide
CID 16773401
6-N-(2,5-dimethylphenyl)-2-N-(4-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100172
N-(5-amino-2-methylphenyl)-2-chloro-4-methylbenzamide
CID 106860345

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide?
The IUPAC name of N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide (CID 16781532) is N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)Nc2cc(N)ccc2C)n1.
What is the InChIKey of N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide?
The InChIKey is KXRDLGMDMCNCOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-9-6-7-11(15)8-13(9)17-14(18)12-5-3-4-10(2)16-12/h3-8H,15H2,1-2H3,(H,17,18).
What are the key properties of N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide?
N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide has a molecular weight of 241.29 g/mol, XLogP of 2.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-methylphenyl)-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 16781532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).