N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide

C14H15N3O — CID 12562155

IUPACN,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide
SMILESCc1nc(C(=O)N(C)C)cc(-c2ccccc2)n1
InChIInChI=1S/C14H15N3O/c1-10-15-12(11-7-5-4-6-8-11)9-13(16-10)14(18)17(2)3/h4-9H,1-3H3
InChIKeyQSJKCPMJKKZPDV-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.15
Rot. Bonds2

About N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide

N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide (PubChem CID 12562155) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide
PubChem CID12562155
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide
SMILESCc1nc(C(=O)N(C)C)cc(-c2ccccc2)n1
InChIInChI=1S/C14H15N3O/c1-10-15-12(11-7-5-4-6-8-11)9-13(16-10)14(18)17(2)3/h4-9H,1-3H3
InChIKeyQSJKCPMJKKZPDV-UHFFFAOYSA-N
XLogP2.15
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methyl-6-phenylpyrimidin-4-yl)propan-1-one
CID 12562149
2-methyl-1-(2-methyl-6-phenylpyrimidin-4-yl)propan-1-one
CID 12562150
2-N,2-N,6-N,6-N-tetramethylpyridine-2,6-dicarboxamide
CID 10955130
N,N,4,6-tetraphenylpyridine-2-carboxamide
CID 71324032
2-amino-N,N-dimethyl-6-(4-prop-2-enoxyphenyl)pyrimidine-4-carboxamide
CID 54852281
4-methyl-6-phenylpyrimidine-2-carboxylic acid
CID 12846711
2-(2-methyl-6-phenylpyrimidin-4-yl)oxybenzoic acid
CID 16643374
ethyl 2,6-diphenylpyrimidine-4-carboxylate
CID 15372800
4-methyl-6-phenylpyrimidine-2-carboxamide
CID 12562158
2-methyl-6-(1-methylindol-3-yl)pyrimidine-4-carboxylic acid
CID 82304798
6-[[(3R)-1-benzoylpiperidin-3-yl]methyl]-N,N,2-trimethylpyrimidine-4-carboxamide
CID 124986814
6-(2-methoxyphenyl)-2-methylpyrimidine-4-carboxamide
CID 67546414

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide?
The IUPAC name of N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide (CID 12562155) is N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide.
What is the SMILES notation for N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide?
The canonical SMILES for N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide is Cc1nc(C(=O)N(C)C)cc(-c2ccccc2)n1.
What is the InChIKey of N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide?
The InChIKey is QSJKCPMJKKZPDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-15-12(11-7-5-4-6-8-11)9-13(16-10)14(18)17(2)3/h4-9H,1-3H3.
What are the key properties of N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide?
N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide has a molecular weight of 241.29 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-6-phenylpyrimidine-4-carboxamide is sourced from PubChem (CID 12562155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).