N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide

C15H17N3O — CID 43548085

IUPACN-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2c(N)ccc(C)c2C)cn1
InChIInChI=1S/C15H17N3O/c1-9-4-7-13(16)14(11(9)3)18-15(19)12-6-5-10(2)17-8-12/h4-8H,16H2,1-3H3,(H,18,19)
InChIKeyIEGPTARDTXUNNV-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.84
Rot. Bonds2

About N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide

N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide (PubChem CID 43548085) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide
PubChem CID43548085
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2c(N)ccc(C)c2C)cn1
InChIInChI=1S/C15H17N3O/c1-9-4-7-13(16)14(11(9)3)18-15(19)12-6-5-10(2)17-8-12/h4-8H,16H2,1-3H3,(H,18,19)
InChIKeyIEGPTARDTXUNNV-UHFFFAOYSA-N
XLogP2.84
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-amino-2,6-dimethylphenyl)-6-methylpyridine-3-carboxamide
CID 24705702
N-(2-amino-6-methylphenyl)-6-methylpyridine-3-carboxamide
CID 43152306
N-(6-amino-2,3-dimethylphenyl)-4-bromobenzamide
CID 43548126
N-(4-amino-3-bromophenyl)-6-methylpyridine-3-carboxamide
CID 82861470
N-(6-amino-2,3-dimethylphenyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 43548027
N-(4-amino-3-chlorophenyl)-6-methylpyridine-3-carboxamide
CID 82862313
N-(6-amino-2,3-dimethylphenyl)-3-chloro-4-iodobenzamide
CID 103218671
N-(6-amino-2,3-dimethylphenyl)-1,3-benzodioxole-5-carboxamide
CID 43548108
6-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide
CID 18148418
N-(3-amino-2,6-dimethylphenyl)pyridazine-4-carboxamide
CID 104669075
6-methyl-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 46439271
6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide
CID 112741980

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide (CID 43548085) is N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide is Cc1ccc(C(=O)Nc2c(N)ccc(C)c2C)cn1.
What is the InChIKey of N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is IEGPTARDTXUNNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-9-4-7-13(16)14(11(9)3)18-15(19)12-6-5-10(2)17-8-12/h4-8H,16H2,1-3H3,(H,18,19).
What are the key properties of N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide?
N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-2,3-dimethylphenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 43548085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).