N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide

C15H17N3O2 — CID 110860112

IUPACN-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide
SMILESCOc1ccc(NC(=O)c2c(C)nc(C)nc2C)cc1
InChIInChI=1S/C15H17N3O2/c1-9-14(10(2)17-11(3)16-9)15(19)18-12-5-7-13(20-4)8-6-12/h5-8H,1-4H3,(H,18,19)
InChIKeyVNZRHDXLRZKRDE-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.66
Rot. Bonds3

About N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide

N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide (PubChem CID 110860112) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide
PubChem CID110860112
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide
SMILESCOc1ccc(NC(=O)c2c(C)nc(C)nc2C)cc1
InChIInChI=1S/C15H17N3O2/c1-9-14(10(2)17-11(3)16-9)15(19)18-12-5-7-13(20-4)8-6-12/h5-8H,1-4H3,(H,18,19)
InChIKeyVNZRHDXLRZKRDE-UHFFFAOYSA-N
XLogP2.66
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,4,6-trimethyl-N-[4-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
CID 110860959
2,3,5,6-tetrafluoro-1-N,4-N-bis(4-methoxyphenyl)benzene-1,4-dicarboxamide
CID 1014494
5-chloro-N-(4-methoxyphenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 47137680
2-chloro-N-(4-methoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
CID 4862032
6-(4-chloroanilino)-N-(4-methoxyphenyl)-2-methylpyrimidine-4-carboxamide
CID 112850129
N-(4-chlorophenyl)-6-(4-methoxyanilino)-2-methylpyrimidine-4-carboxamide
CID 112850162
1,3-bis(4-methoxyphenyl)urea
CID 139045428
6-chloro-N-(4-methoxyphenyl)-2-methyl-4-phenylquinoline-3-carboxamide
CID 8966053
N-(4-methoxyphenyl)anthracene-9-carboxamide
CID 86045651
2-bromo-6-fluoro-N-(4-methoxyphenyl)benzamide
CID 115678058
N-(4-methoxyphenyl)-1-methylpyridin-1-ium-4-carboxamide
CID 1110822
1-benzyl-N-(4-methoxyphenyl)-3,5-dimethylpyrazole-4-carboxamide
CID 9042189

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide (CID 110860112) is N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide is COc1ccc(NC(=O)c2c(C)nc(C)nc2C)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide?
The InChIKey is VNZRHDXLRZKRDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-9-14(10(2)17-11(3)16-9)15(19)18-12-5-7-13(20-4)8-6-12/h5-8H,1-4H3,(H,18,19).
What are the key properties of N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide?
N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2,4,6-trimethylpyrimidine-5-carboxamide is sourced from PubChem (CID 110860112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).