6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one

C19H14FN3O — CID 19967130

IUPAC6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one
SMILESO=c1ccc2cc(C(c3ccc(F)cc3)n3ccnc3)ccc2[nH]1
InChIInChI=1S/C19H14FN3O/c20-16-5-1-13(2-6-16)19(23-10-9-21-12-23)15-3-7-17-14(11-15)4-8-18(24)22-17/h1-12,19H,(H,22,24)
InChIKeyZDZLRNHJKHSMJO-UHFFFAOYSA-N
MW319.34 g/mol
LogP3.50
Rot. Bonds3

About 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one

6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one (PubChem CID 19967130) has the molecular formula C19H14FN3O and a molecular weight of 319.34 g/mol. Its IUPAC name is 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one
PubChem CID19967130
Molecular FormulaC19H14FN3O
Molecular Weight319.34 g/mol
Exact Mass319.11
IUPAC Name6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one
SMILESO=c1ccc2cc(C(c3ccc(F)cc3)n3ccnc3)ccc2[nH]1
InChIInChI=1S/C19H14FN3O/c20-16-5-1-13(2-6-16)19(23-10-9-21-12-23)15-3-7-17-14(11-15)4-8-18(24)22-17/h1-12,19H,(H,22,24)
InChIKeyZDZLRNHJKHSMJO-UHFFFAOYSA-N
XLogP3.50
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one?
The IUPAC name of 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one (CID 19967130) is 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one.
What is the SMILES notation for 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one?
The canonical SMILES for 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one is O=c1ccc2cc(C(c3ccc(F)cc3)n3ccnc3)ccc2[nH]1.
What is the InChIKey of 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one?
The InChIKey is ZDZLRNHJKHSMJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3O/c20-16-5-1-13(2-6-16)19(23-10-9-21-12-23)15-3-7-17-14(11-15)4-8-18(24)22-17/h1-12,19H,(H,22,24).
What are the key properties of 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one?
6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one has a molecular weight of 319.34 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-fluorophenyl)-imidazol-1-ylmethyl]-1H-quinolin-2-one is sourced from PubChem (CID 19967130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).