3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine

C19H19F2N3 — CID 113228766

IUPAC3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine
SMILESCC(C)c1nc(-c2ccc(F)cc2F)c(N)n1Cc1ccccc1
InChIInChI=1S/C19H19F2N3/c1-12(2)19-23-17(15-9-8-14(20)10-16(15)21)18(22)24(19)11-13-6-4-3-5-7-13/h3-10,12H,11,22H2,1-2H3
InChIKeyJCFJJGJHFVDIRB-UHFFFAOYSA-N
MW327.38 g/mol
LogP4.58
Rot. Bonds4

About 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine

3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine (PubChem CID 113228766) has the molecular formula C19H19F2N3 and a molecular weight of 327.38 g/mol. Its IUPAC name is 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine.

Molecular Properties

Compound Name3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine
PubChem CID113228766
Molecular FormulaC19H19F2N3
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC Name3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine
SMILESCC(C)c1nc(-c2ccc(F)cc2F)c(N)n1Cc1ccccc1
InChIInChI=1S/C19H19F2N3/c1-12(2)19-23-17(15-9-8-14(20)10-16(15)21)18(22)24(19)11-13-6-4-3-5-7-13/h3-10,12H,11,22H2,1-2H3
InChIKeyJCFJJGJHFVDIRB-UHFFFAOYSA-N
XLogP4.58
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-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

3-butyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine
CID 62220167
3-benzyl-2-propan-2-yl-5-(2,4,6-trimethylphenyl)imidazol-4-amine
CID 113232523
5-(2,4-difluorophenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine
CID 62224859
5-(4-bromo-2-fluorophenyl)-3-(2-methylpropyl)-2-propan-2-ylimidazol-4-amine
CID 63467465
3-benzyl-5-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylimidazol-4-amine
CID 113268833
5-(2,4-difluorophenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine
CID 62218894
5-(2-fluorophenyl)-2,3-di(propan-2-yl)imidazol-4-amine
CID 62219797
2-benzyl-4-(2,4-difluorophenyl)-6-N-[2-(dimethylamino)ethyl]pyrazolo[3,4-d]pyrimidine-3,6-diamine
CID 42668740
5-(4-fluoro-2-methylphenyl)-2,3-di(propan-2-yl)imidazol-4-amine
CID 62219616
5-(3-chloro-2-fluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
CID 114488594
3-[(4-fluorophenyl)methyl]-2-propan-2-ylbenzo[e]benzimidazole-4,5-dione
CID 123812154
1-benzyl-4,5-diphenyl-2-propan-2-ylimidazole
CID 102274301

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine?
The IUPAC name of 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine (CID 113228766) is 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine.
What is the SMILES notation for 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine?
The canonical SMILES for 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine is CC(C)c1nc(-c2ccc(F)cc2F)c(N)n1Cc1ccccc1.
What is the InChIKey of 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine?
The InChIKey is JCFJJGJHFVDIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N3/c1-12(2)19-23-17(15-9-8-14(20)10-16(15)21)18(22)24(19)11-13-6-4-3-5-7-13/h3-10,12H,11,22H2,1-2H3.
What are the key properties of 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine?
3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine has a molecular weight of 327.38 g/mol, XLogP of 4.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine is sourced from PubChem (CID 113228766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).