N-(2,6-diphenylpyrimidin-4-yl)acetamide

C18H15N3O — CID 11185362

IUPACN-(2,6-diphenylpyrimidin-4-yl)acetamide
SMILESCC(=O)Nc1cc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C18H15N3O/c1-13(22)19-17-12-16(14-8-4-2-5-9-14)20-18(21-17)15-10-6-3-7-11-15/h2-12H,1H3,(H,19,20,21,22)
InChIKeyZFBASLSZDCISGS-UHFFFAOYSA-N
MW289.34 g/mol
LogP3.77
Rot. Bonds3

About N-(2,6-diphenylpyrimidin-4-yl)acetamide

N-(2,6-diphenylpyrimidin-4-yl)acetamide (PubChem CID 11185362) has the molecular formula C18H15N3O and a molecular weight of 289.34 g/mol. Its IUPAC name is N-(2,6-diphenylpyrimidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(2,6-diphenylpyrimidin-4-yl)acetamide
PubChem CID11185362
Molecular FormulaC18H15N3O
Molecular Weight289.34 g/mol
Exact Mass289.12
IUPAC NameN-(2,6-diphenylpyrimidin-4-yl)acetamide
SMILESCC(=O)Nc1cc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C18H15N3O/c1-13(22)19-17-12-16(14-8-4-2-5-9-14)20-18(21-17)15-10-6-3-7-11-15/h2-12H,1H3,(H,19,20,21,22)
InChIKeyZFBASLSZDCISGS-UHFFFAOYSA-N
XLogP3.77
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,6-Diphenylpyrimidin-2-amine
CID 619024
2-Chloro-4,6-diphenylpyrimidine
CID 1804739
Luf-5735
CID 11392960
5-Phenyl-6-(3-phenylpropyl)pyrimidine-2,4-diamine
CID 9814965
4-Amino-2,6-diphenylpyrimidine
CID 619020
2-N-benzyl-4-N-butyl-6-methylpyrimidine-2,4-diamine
CID 659917
4-Amino-2,6-diphenylpyrimidine-5-carbonitrile
CID 2303947
N-(4,6-diphenylpyrimidin-2-yl)-3-methylbutyramide
CID 11301995
N-(4,6-diphenylpyrimidin-2-yl)benzamide
CID 11314132
Pentanoic acid (4,6-diphenylpyrimidin-2-yl)amide
CID 11450364
N2-benzyl-N4-cyclohexyl-6-methylpyrimidine-2,4-diamine
CID 697226
N~2~-benzyl-6-methyl-N~4~-(4-methylphenyl)-2,4-pyrimidinediamine
CID 721060

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diphenylpyrimidin-4-yl)acetamide?
The IUPAC name of N-(2,6-diphenylpyrimidin-4-yl)acetamide (CID 11185362) is N-(2,6-diphenylpyrimidin-4-yl)acetamide.
What is the SMILES notation for N-(2,6-diphenylpyrimidin-4-yl)acetamide?
The canonical SMILES for N-(2,6-diphenylpyrimidin-4-yl)acetamide is CC(=O)Nc1cc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of N-(2,6-diphenylpyrimidin-4-yl)acetamide?
The InChIKey is ZFBASLSZDCISGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O/c1-13(22)19-17-12-16(14-8-4-2-5-9-14)20-18(21-17)15-10-6-3-7-11-15/h2-12H,1H3,(H,19,20,21,22).
What are the key properties of N-(2,6-diphenylpyrimidin-4-yl)acetamide?
N-(2,6-diphenylpyrimidin-4-yl)acetamide has a molecular weight of 289.34 g/mol, XLogP of 3.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diphenylpyrimidin-4-yl)acetamide is sourced from PubChem (CID 11185362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).