1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine

C16H16FN3O — CID 79500811

IUPAC1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
SMILESCOc1ccc(C2CN=C(N)N2c2ccccc2F)cc1
InChIInChI=1S/C16H16FN3O/c1-21-12-8-6-11(7-9-12)15-10-19-16(18)20(15)14-5-3-2-4-13(14)17/h2-9,15H,10H2,1H3,(H2,18,19)
InChIKeyNTIAMLBDHCFAPS-UHFFFAOYSA-N
MW285.32 g/mol
LogP2.71
Rot. Bonds3

About 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine

1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79500811) has the molecular formula C16H16FN3O and a molecular weight of 285.32 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79500811
Molecular FormulaC16H16FN3O
Molecular Weight285.32 g/mol
Exact Mass285.13
IUPAC Name1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
SMILESCOc1ccc(C2CN=C(N)N2c2ccccc2F)cc1
InChIInChI=1S/C16H16FN3O/c1-21-12-8-6-11(7-9-12)15-10-19-16(18)20(15)14-5-3-2-4-13(14)17/h2-9,15H,10H2,1H3,(H2,18,19)
InChIKeyNTIAMLBDHCFAPS-UHFFFAOYSA-N
XLogP2.71
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine (CID 79500811) is 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine is COc1ccc(C2CN=C(N)N2c2ccccc2F)cc1.
What is the InChIKey of 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is NTIAMLBDHCFAPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O/c1-21-12-8-6-11(7-9-12)15-10-19-16(18)20(15)14-5-3-2-4-13(14)17/h2-9,15H,10H2,1H3,(H2,18,19).
What are the key properties of 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 285.32 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79500811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).