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

C16H15ClFN3 — CID 79499908

IUPAC1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1cc(C2CN=C(N)N2c2ccccc2Cl)ccc1F
InChIInChI=1S/C16H15ClFN3/c1-10-8-11(6-7-13(10)18)15-9-20-16(19)21(15)14-5-3-2-4-12(14)17/h2-8,15H,9H2,1H3,(H2,19,20)
InChIKeySUTAFEQULSXKIL-UHFFFAOYSA-N
MW303.77 g/mol
LogP3.66
Rot. Bonds2

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

1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79499908) has the molecular formula C16H15ClFN3 and a molecular weight of 303.77 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79499908
Molecular FormulaC16H15ClFN3
Molecular Weight303.77 g/mol
Exact Mass303.09
IUPAC Name1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1cc(C2CN=C(N)N2c2ccccc2Cl)ccc1F
InChIInChI=1S/C16H15ClFN3/c1-10-8-11(6-7-13(10)18)15-9-20-16(19)21(15)14-5-3-2-4-12(14)17/h2-8,15H,9H2,1H3,(H2,19,20)
InChIKeySUTAFEQULSXKIL-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-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine (CID 79499908) is 1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine is Cc1cc(C2CN=C(N)N2c2ccccc2Cl)ccc1F.
What is the InChIKey of 1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is SUTAFEQULSXKIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFN3/c1-10-8-11(6-7-13(10)18)15-9-20-16(19)21(15)14-5-3-2-4-12(14)17/h2-8,15H,9H2,1H3,(H2,19,20).
What are the key properties of 1-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine?
1-(2-chlorophenyl)-5-(4-fluoro-3-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-(2-chlorophenyl)-5-(4-fluoro-3-methylphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79499908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).