N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide

C15H17N3O2 — CID 110851542

IUPACN-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cc(C)nc(C)n1
InChIInChI=1S/C15H17N3O2/c1-10-8-13(18-11(2)17-10)15(19)16-9-12-6-4-5-7-14(12)20-3/h4-8H,9H2,1-3H3,(H,16,19)
InChIKeyNJDMGNMKZCCCIM-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.03
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide

N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide (PubChem CID 110851542) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide
PubChem CID110851542
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cc(C)nc(C)n1
InChIInChI=1S/C15H17N3O2/c1-10-8-13(18-11(2)17-10)15(19)16-9-12-6-4-5-7-14(12)20-3/h4-8H,9H2,1-3H3,(H,16,19)
InChIKeyNJDMGNMKZCCCIM-UHFFFAOYSA-N
XLogP2.03
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-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

N-[(2-methoxyphenyl)methyl]-6-[(2-methoxyphenyl)methylamino]-2-methylpyrimidine-4-carboxamide
CID 109370200
6-(diethylamino)-N-[(2-methoxyphenyl)methyl]-2-methylpyrimidine-4-carboxamide
CID 109370286
6-(4-methoxyanilino)-N-[(2-methoxyphenyl)methyl]-2-methylpyrimidine-4-carboxamide
CID 109370328
N-[(2-methoxyphenyl)methyl]-6-[(4-methoxyphenyl)methylamino]-2-methylpyrimidine-4-carboxamide
CID 109370274
N-[(2-methoxyphenyl)methyl]-2-(3-methoxypropylamino)-6-methylpyrimidine-4-carboxamide
CID 109323874
2-[benzyl(methyl)amino]-N-[(2-methoxyphenyl)methyl]-6-methylpyrimidine-4-carboxamide
CID 109328208
N-[(2-methoxyphenyl)methyl]-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365354
2-[2-(4-fluorophenyl)ethylamino]-N-[(2-methoxyphenyl)methyl]-6-methylpyrimidine-4-carboxamide
CID 109329169
N-[(2-methoxyphenyl)methyl]-6-methyl-2-(3-phenylpropylamino)pyrimidine-4-carboxamide
CID 109329174
2-(3,4-dihydro-2H-quinolin-1-yl)-N-[(2-methoxyphenyl)methyl]-6-methylpyrimidine-4-carboxamide
CID 109329190
N-[2-(2-fluorophenyl)ethyl]-2-[(2-methoxyphenyl)methylamino]-6-methylpyrimidine-4-carboxamide
CID 109329095
N-(2-methoxyphenyl)-2-[(2-methoxyphenyl)methylamino]-6-methylpyrimidine-4-carboxamide
CID 109329140

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide (CID 110851542) is N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide is COc1ccccc1CNC(=O)c1cc(C)nc(C)n1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide?
The InChIKey is NJDMGNMKZCCCIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-8-13(18-11(2)17-10)15(19)16-9-12-6-4-5-7-14(12)20-3/h4-8H,9H2,1-3H3,(H,16,19).
What are the key properties of N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide?
N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2,6-dimethylpyrimidine-4-carboxamide is sourced from PubChem (CID 110851542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).