6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide

C16H13FN2O2 — CID 110635094

IUPAC6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide
SMILESO=C1CCN(C(=O)Nc2ccccc2)c2ccc(F)cc21
InChIInChI=1S/C16H13FN2O2/c17-11-6-7-14-13(10-11)15(20)8-9-19(14)16(21)18-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,18,21)
InChIKeyHLHLPENBUAHFAN-UHFFFAOYSA-N
MW284.29 g/mol
LogP3.45
Rot. Bonds1

About 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide

6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide (PubChem CID 110635094) has the molecular formula C16H13FN2O2 and a molecular weight of 284.29 g/mol. Its IUPAC name is 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide.

Molecular Properties

Compound Name6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide
PubChem CID110635094
Molecular FormulaC16H13FN2O2
Molecular Weight284.29 g/mol
Exact Mass284.10
IUPAC Name6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide
SMILESO=C1CCN(C(=O)Nc2ccccc2)c2ccc(F)cc21
InChIInChI=1S/C16H13FN2O2/c17-11-6-7-14-13(10-11)15(20)8-9-19(14)16(21)18-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,18,21)
InChIKeyHLHLPENBUAHFAN-UHFFFAOYSA-N
XLogP3.45
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide?
The IUPAC name of 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide (CID 110635094) is 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide.
What is the SMILES notation for 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide?
The canonical SMILES for 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide is O=C1CCN(C(=O)Nc2ccccc2)c2ccc(F)cc21.
What is the InChIKey of 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide?
The InChIKey is HLHLPENBUAHFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O2/c17-11-6-7-14-13(10-11)15(20)8-9-19(14)16(21)18-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,18,21).
What are the key properties of 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide?
6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide has a molecular weight of 284.29 g/mol, XLogP of 3.45, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide is sourced from PubChem (CID 110635094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).