1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine

C10H12FN3 — CID 166161661

IUPAC1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine
SMILESNC1=NCCN1Cc1ccc(F)cc1
InChIInChI=1S/C10H12FN3/c11-9-3-1-8(2-4-9)7-14-6-5-13-10(14)12/h1-4H,5-7H2,(H2,12,13)
InChIKeyZYJWWWZJFUDCCG-UHFFFAOYSA-N
MW193.23 g/mol
LogP0.96
Rot. Bonds2

About 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine

1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine (PubChem CID 166161661) has the molecular formula C10H12FN3 and a molecular weight of 193.23 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine
PubChem CID166161661
Molecular FormulaC10H12FN3
Molecular Weight193.23 g/mol
Exact Mass193.10
IUPAC Name1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine
SMILESNC1=NCCN1Cc1ccc(F)cc1
InChIInChI=1S/C10H12FN3/c11-9-3-1-8(2-4-9)7-14-6-5-13-10(14)12/h1-4H,5-7H2,(H2,12,13)
InChIKeyZYJWWWZJFUDCCG-UHFFFAOYSA-N
XLogP0.96
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-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

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine (CID 166161661) is 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine is NC1=NCCN1Cc1ccc(F)cc1.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine?
The InChIKey is ZYJWWWZJFUDCCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3/c11-9-3-1-8(2-4-9)7-14-6-5-13-10(14)12/h1-4H,5-7H2,(H2,12,13).
What are the key properties of 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine?
1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine has a molecular weight of 193.23 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 166161661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).