N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine

C17H19N5 — CID 133403457

IUPACN-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine
SMILESCc1cnc(N(C)Cc2nccn2Cc2ccccc2)nc1
InChIInChI=1S/C17H19N5/c1-14-10-19-17(20-11-14)21(2)13-16-18-8-9-22(16)12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3
InChIKeyXAFYPVRGJDUUAJ-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.67
Rot. Bonds5

About N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine

N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine (PubChem CID 133403457) has the molecular formula C17H19N5 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine.

Molecular Properties

Compound NameN-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine
PubChem CID133403457
Molecular FormulaC17H19N5
Molecular Weight293.37 g/mol
Exact Mass293.16
IUPAC NameN-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine
SMILESCc1cnc(N(C)Cc2nccn2Cc2ccccc2)nc1
InChIInChI=1S/C17H19N5/c1-14-10-19-17(20-11-14)21(2)13-16-18-8-9-22(16)12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3
InChIKeyXAFYPVRGJDUUAJ-UHFFFAOYSA-N
XLogP2.67
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-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

2-(1-benzylimidazol-2-yl)-N,N-dimethylacetamide
CID 54563123
N-[(1-benzylimidazol-2-yl)methyl]-N-methyl-2-nitroaniline
CID 133324452
1-benzyl-2-methylimidazole
CID 158634472
(1-benzylimidazol-2-yl)methanamine;dihydrochloride
CID 13478012
(3S,5R)-3-[(1-benzylimidazol-2-yl)methyl-methylamino]-5-methyloxolan-2-one
CID 95902998
N-[(1-benzylimidazol-2-yl)methyl]-N-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
CID 133324438
N,5-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 171328176
2-(1-benzylimidazol-2-yl)acetonitrile;ethane
CID 144979693
N-[(1-benzylimidazol-2-yl)methyl]-N-methyl-1-(2-methylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 75379896
N-[(1-benzylimidazol-2-yl)methyl]-6-(4-fluorophenyl)-N-methylpyridazin-3-amine
CID 133324440
N-[(1-benzylimidazol-2-yl)methyl]-1-(5-chlorothiadiazol-4-yl)-N-methylmethanamine
CID 71988775
N-[(1-benzylimidazol-2-yl)methyl]ethanamine;hydrochloride
CID 45156296

Frequently Asked Questions

What is the IUPAC name of N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine?
The IUPAC name of N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine (CID 133403457) is N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine.
What is the SMILES notation for N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine?
The canonical SMILES for N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine is Cc1cnc(N(C)Cc2nccn2Cc2ccccc2)nc1.
What is the InChIKey of N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine?
The InChIKey is XAFYPVRGJDUUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5/c1-14-10-19-17(20-11-14)21(2)13-16-18-8-9-22(16)12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3.
What are the key properties of N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine?
N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine has a molecular weight of 293.37 g/mol, XLogP of 2.67, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-benzylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-2-amine is sourced from PubChem (CID 133403457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).