N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine

C22H22N4 — CID 42740245

IUPACN-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
SMILESCc1ccc(-c2nc3nc(C)cc(C)n3c2NCc2ccccc2)cc1
InChIInChI=1S/C22H22N4/c1-15-9-11-19(12-10-15)20-21(23-14-18-7-5-4-6-8-18)26-17(3)13-16(2)24-22(26)25-20/h4-13,23H,14H2,1-3H3
InChIKeyUXUDXLYNLLDTAA-UHFFFAOYSA-N
MW342.45 g/mol
LogP4.93
Rot. Bonds4

About N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine

N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine (PubChem CID 42740245) has the molecular formula C22H22N4 and a molecular weight of 342.45 g/mol. Its IUPAC name is N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine.

Molecular Properties

Compound NameN-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
PubChem CID42740245
Molecular FormulaC22H22N4
Molecular Weight342.45 g/mol
Exact Mass342.18
IUPAC NameN-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
SMILESCc1ccc(-c2nc3nc(C)cc(C)n3c2NCc2ccccc2)cc1
InChIInChI=1S/C22H22N4/c1-15-9-11-19(12-10-15)20-21(23-14-18-7-5-4-6-8-18)26-17(3)13-16(2)24-22(26)25-20/h4-13,23H,14H2,1-3H3
InChIKeyUXUDXLYNLLDTAA-UHFFFAOYSA-N
XLogP4.93
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.45
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-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

3,5,7-trimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine
CID 115281773
N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 808678
N-[(4-methylphenyl)methyl]-2-phenylimidazo[1,2-a]pyrimidin-3-amine
CID 20952793
N-benzyl-5,7-dimethyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 808782
ethyl 5-(benzylamino)-3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-2-carboxylate
CID 53204793
N-[(3-chlorophenyl)methyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 59402651
N-benzyl-4,6-dimethylpyridin-2-amine
CID 14593016
N-benzyl-2-(4-butan-2-ylsulfanylphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine
CID 42600981
N-benzyl-4-methyl-6-phenylpyrimidin-2-amine
CID 13126867
5,7-dimethyl-N-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 3620899
N-benzyl-2,6-dimethylquinolin-4-amine
CID 719873
1-(4-methylphenyl)-N-[(5-phenyl-2H-triazol-4-yl)methyl]methanamine
CID 63641898

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The IUPAC name of N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine (CID 42740245) is N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine.
What is the SMILES notation for N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The canonical SMILES for N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine is Cc1ccc(-c2nc3nc(C)cc(C)n3c2NCc2ccccc2)cc1.
What is the InChIKey of N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The InChIKey is UXUDXLYNLLDTAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4/c1-15-9-11-19(12-10-15)20-21(23-14-18-7-5-4-6-8-18)26-17(3)13-16(2)24-22(26)25-20/h4-13,23H,14H2,1-3H3.
What are the key properties of N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine?
N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine has a molecular weight of 342.45 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine is sourced from PubChem (CID 42740245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).