1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine

C17H18FN3 — CID 25102570

IUPAC1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine
SMILESFc1cccc(CCN2CCN=C2Nc2ccccc2)c1
InChIInChI=1S/C17H18FN3/c18-15-6-4-5-14(13-15)9-11-21-12-10-19-17(21)20-16-7-2-1-3-8-16/h1-8,13H,9-12H2,(H,19,20)
InChIKeyPSKXTHSYOBIMOY-UHFFFAOYSA-N
MW283.35 g/mol
LogP3.15
Rot. Bonds4

About 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine

1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine (PubChem CID 25102570) has the molecular formula C17H18FN3 and a molecular weight of 283.35 g/mol. Its IUPAC name is 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine
PubChem CID25102570
Molecular FormulaC17H18FN3
Molecular Weight283.35 g/mol
Exact Mass283.15
IUPAC Name1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine
SMILESFc1cccc(CCN2CCN=C2Nc2ccccc2)c1
InChIInChI=1S/C17H18FN3/c18-15-6-4-5-14(13-15)9-11-21-12-10-19-17(21)20-16-7-2-1-3-8-16/h1-8,13H,9-12H2,(H,19,20)
InChIKeyPSKXTHSYOBIMOY-UHFFFAOYSA-N
XLogP3.15
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine (CID 25102570) is 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine is Fc1cccc(CCN2CCN=C2Nc2ccccc2)c1.
What is the InChIKey of 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine?
The InChIKey is PSKXTHSYOBIMOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3/c18-15-6-4-5-14(13-15)9-11-21-12-10-19-17(21)20-16-7-2-1-3-8-16/h1-8,13H,9-12H2,(H,19,20).
What are the key properties of 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine?
1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine has a molecular weight of 283.35 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-fluorophenyl)ethyl]-N-phenyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 25102570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).