2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide

C15H17N3O — CID 47255120

IUPAC2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide
SMILESCc1cc(C)c(NC(=O)c2ccnc(C)n2)c(C)c1
InChIInChI=1S/C15H17N3O/c1-9-7-10(2)14(11(3)8-9)18-15(19)13-5-6-16-12(4)17-13/h5-8H,1-4H3,(H,18,19)
InChIKeyVGEWVVXAVSQVKH-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.96
Rot. Bonds2

About 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide

2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide (PubChem CID 47255120) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide
PubChem CID47255120
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide
SMILESCc1cc(C)c(NC(=O)c2ccnc(C)n2)c(C)c1
InChIInChI=1S/C15H17N3O/c1-9-7-10(2)14(11(3)8-9)18-15(19)13-5-6-16-12(4)17-13/h5-8H,1-4H3,(H,18,19)
InChIKeyVGEWVVXAVSQVKH-UHFFFAOYSA-N
XLogP2.96
TPSA54.88 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 ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-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

2-(2-methoxyethylamino)-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide
CID 109299699
2-(4-methoxyanilino)-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide
CID 109316217
N-[2,6-di(propan-2-yl)phenyl]-2-methylpyrimidine-4-carboxamide
CID 60547417
N-(5-chloro-2-methylphenyl)-2-methylpyrimidine-4-carboxamide
CID 47255494
N-(3,4-dichlorophenyl)-2-methylpyrimidine-4-carboxamide
CID 47255119
2-(3-cyanoanilino)-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide
CID 109316241
4-(propan-2-ylamino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
CID 109201591
2,4-dimethyl-5-[(2-methylpyrimidine-4-carbonyl)amino]benzoic acid
CID 146127196
6-N-propan-2-yl-2-N-(2,4,6-trimethylphenyl)pyridine-2,6-dicarboxamide
CID 109093718
4-anilino-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
CID 109218850
2-[(1,1-dioxothiolan-3-yl)amino]-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide
CID 109309149
N-(4-fluorophenyl)-2-(2,4,6-trimethylanilino)pyrimidine-4-carboxamide
CID 109316170

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide (CID 47255120) is 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide is Cc1cc(C)c(NC(=O)c2ccnc(C)n2)c(C)c1.
What is the InChIKey of 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide?
The InChIKey is VGEWVVXAVSQVKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-9-7-10(2)14(11(3)8-9)18-15(19)13-5-6-16-12(4)17-13/h5-8H,1-4H3,(H,18,19).
What are the key properties of 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide?
2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2,4,6-trimethylphenyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 47255120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).