6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine

C15H17N5 — CID 80992722

IUPAC6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(N)nc(C(C)C)nc1-n1cnc2ccccc21
InChIInChI=1S/C15H17N5/c1-9(2)14-18-13(16)10(3)15(19-14)20-8-17-11-6-4-5-7-12(11)20/h4-9H,1-3H3,(H2,16,18,19)
InChIKeyXEBPOAWJPOHKAH-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.83
Rot. Bonds2

About 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine

6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 80992722) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID80992722
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC Name6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(N)nc(C(C)C)nc1-n1cnc2ccccc21
InChIInChI=1S/C15H17N5/c1-9(2)14-18-13(16)10(3)15(19-14)20-8-17-11-6-4-5-7-12(11)20/h4-9H,1-3H3,(H2,16,18,19)
InChIKeyXEBPOAWJPOHKAH-UHFFFAOYSA-N
XLogP2.83
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine 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

6-(benzimidazol-1-yl)-2,5-dimethylpyrimidin-4-amine
CID 80854160
6-(benzimidazol-1-yl)-2-cyclopropyl-5-methylpyrimidin-4-amine
CID 80992517
6-(benzimidazol-1-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80966582
2-(benzimidazol-1-yl)-3-methylquinoxaline
CID 115579889
3-(benzimidazol-1-yl)-1-methylpyrazol-4-amine
CID 103078998
4-(5,6-dimethoxybenzimidazol-1-yl)-2-propan-2-ylquinazoline
CID 21003922
5-methyl-2-propan-2-yl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 80982123
(1S)-1-[4-(benzimidazol-1-yl)phenyl]ethanamine
CID 25324450
1-(2-bromo-4-propan-2-ylphenyl)benzimidazole
CID 174453392
4-(benzimidazol-1-yl)-6-methoxypyrimidin-2-amine
CID 114053321
3-(benzimidazol-1-yl)-4-methylaniline
CID 82512834
5-(benzimidazol-1-yl)-1,3-dimethylpyrazol-4-amine
CID 43554355

Frequently Asked Questions

What is the IUPAC name of 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine (CID 80992722) is 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine is Cc1c(N)nc(C(C)C)nc1-n1cnc2ccccc21.
What is the InChIKey of 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is XEBPOAWJPOHKAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-9(2)14-18-13(16)10(3)15(19-14)20-8-17-11-6-4-5-7-12(11)20/h4-9H,1-3H3,(H2,16,18,19).
What are the key properties of 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 267.34 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(benzimidazol-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80992722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).