4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide

C14H15N3O — CID 79234917

IUPAC4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide
SMILESCc1cc(NC(=O)c2ccc(N)c(C)c2)ccn1
InChIInChI=1S/C14H15N3O/c1-9-7-11(3-4-13(9)15)14(18)17-12-5-6-16-10(2)8-12/h3-8H,15H2,1-2H3,(H,16,17,18)
InChIKeyMJYCPBAGEUBFDQ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.53
Rot. Bonds2

About 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide

4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide (PubChem CID 79234917) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide.

Molecular Properties

Compound Name4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide
PubChem CID79234917
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide
SMILESCc1cc(NC(=O)c2ccc(N)c(C)c2)ccn1
InChIInChI=1S/C14H15N3O/c1-9-7-11(3-4-13(9)15)14(18)17-12-5-6-16-10(2)8-12/h3-8H,15H2,1-2H3,(H,16,17,18)
InChIKeyMJYCPBAGEUBFDQ-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

2-amino-N-(2-methyl-4-pyridinyl)benzamide
CID 79235729
3-bromo-4-chloro-N-(2-methyl-4-pyridinyl)benzamide
CID 110678414
4-(methylamino)-N-(2-methyl-4-pyridinyl)benzamide
CID 79240980
2-amino-5-methoxy-N-(2-methyl-4-pyridinyl)benzamide
CID 79235180
2-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-4-carboxamide
CID 79240155
N-(2-methyl-4-pyridinyl)-2-oxo-1,3-dihydrobenzimidazole-5-carboxamide
CID 110692425
3-amino-N-[3-[(2-methyl-4-pyridinyl)amino]phenyl]benzamide
CID 157042720
4-[(2-methyl-4-pyridinyl)amino]-N-[4-[(2-methyl-4-pyridinyl)amino]phenyl]benzamide
CID 157044269
4-amino-N-(3-hydroxyphenyl)-3-methylbenzamide
CID 61167676
N-(3-amino-2,6-dimethylphenyl)-2-methylpyridine-4-carboxamide
CID 106752359
4-amino-N-(3-chlorophenyl)-3-methylbenzamide
CID 16785313
4-amino-3-methyl-N-(1,2-oxazol-3-yl)benzamide
CID 62903600

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide?
The IUPAC name of 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide (CID 79234917) is 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide.
What is the SMILES notation for 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide?
The canonical SMILES for 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide is Cc1cc(NC(=O)c2ccc(N)c(C)c2)ccn1.
What is the InChIKey of 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide?
The InChIKey is MJYCPBAGEUBFDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-9-7-11(3-4-13(9)15)14(18)17-12-5-6-16-10(2)8-12/h3-8H,15H2,1-2H3,(H,16,17,18).
What are the key properties of 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide?
4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide 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 4-amino-3-methyl-N-(2-methyl-4-pyridinyl)benzamide is sourced from PubChem (CID 79234917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).