1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine

C16H16FN3 — CID 79505515

IUPAC1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine
SMILESCC1(c2ccccc2)CN=C(N)N1c1ccc(F)cc1
InChIInChI=1S/C16H16FN3/c1-16(12-5-3-2-4-6-12)11-19-15(18)20(16)14-9-7-13(17)8-10-14/h2-10H,11H2,1H3,(H2,18,19)
InChIKeyKHBKPSGTSGQOND-UHFFFAOYSA-N
MW269.32 g/mol
LogP2.88
Rot. Bonds2

About 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine

1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine (PubChem CID 79505515) has the molecular formula C16H16FN3 and a molecular weight of 269.32 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine
PubChem CID79505515
Molecular FormulaC16H16FN3
Molecular Weight269.32 g/mol
Exact Mass269.13
IUPAC Name1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine
SMILESCC1(c2ccccc2)CN=C(N)N1c1ccc(F)cc1
InChIInChI=1S/C16H16FN3/c1-16(12-5-3-2-4-6-12)11-19-15(18)20(16)14-9-7-13(17)8-10-14/h2-10H,11H2,1H3,(H2,18,19)
InChIKeyKHBKPSGTSGQOND-UHFFFAOYSA-N
XLogP2.88
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine?
The IUPAC name of 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine (CID 79505515) is 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine?
The canonical SMILES for 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine is CC1(c2ccccc2)CN=C(N)N1c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine?
The InChIKey is KHBKPSGTSGQOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3/c1-16(12-5-3-2-4-6-12)11-19-15(18)20(16)14-9-7-13(17)8-10-14/h2-10H,11H2,1H3,(H2,18,19).
What are the key properties of 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine?
1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine has a molecular weight of 269.32 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-5-methyl-5-phenyl-4H-imidazol-2-amine is sourced from PubChem (CID 79505515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).