1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine

C16H15ClFN3 — CID 79501134

IUPAC1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1ccc(C2CN=C(N)N2c2ccc(Cl)cc2)cc1F
InChIInChI=1S/C16H15ClFN3/c1-10-2-3-11(8-14(10)18)15-9-20-16(19)21(15)13-6-4-12(17)5-7-13/h2-8,15H,9H2,1H3,(H2,19,20)
InChIKeySGONEAXQVCZNIN-UHFFFAOYSA-N
MW303.77 g/mol
LogP3.66
Rot. Bonds2

About 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine

1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79501134) has the molecular formula C16H15ClFN3 and a molecular weight of 303.77 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79501134
Molecular FormulaC16H15ClFN3
Molecular Weight303.77 g/mol
Exact Mass303.09
IUPAC Name1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1ccc(C2CN=C(N)N2c2ccc(Cl)cc2)cc1F
InChIInChI=1S/C16H15ClFN3/c1-10-2-3-11(8-14(10)18)15-9-20-16(19)21(15)13-6-4-12(17)5-7-13/h2-8,15H,9H2,1H3,(H2,19,20)
InChIKeySGONEAXQVCZNIN-UHFFFAOYSA-N
XLogP3.66
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.77
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine (CID 79501134) is 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine is Cc1ccc(C2CN=C(N)N2c2ccc(Cl)cc2)cc1F.
What is the InChIKey of 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is SGONEAXQVCZNIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFN3/c1-10-2-3-11(8-14(10)18)15-9-20-16(19)21(15)13-6-4-12(17)5-7-13/h2-8,15H,9H2,1H3,(H2,19,20).
What are the key properties of 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine?
1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 303.77 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79501134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).