4-fluoro-N-quinolin-8-ylbenzamide

C16H11FN2O — CID 790260

IUPAC4-fluoro-N-quinolin-8-ylbenzamide
SMILESO=C(Nc1cccc2cccnc12)c1ccc(F)cc1
InChIInChI=1S/C16H11FN2O/c17-13-8-6-12(7-9-13)16(20)19-14-5-1-3-11-4-2-10-18-15(11)14/h1-10H,(H,19,20)
InChIKeyMJUMNSKVSKDCLR-UHFFFAOYSA-N
MW266.28 g/mol
LogP3.63
Rot. Bonds2

About 4-fluoro-N-quinolin-8-ylbenzamide

4-fluoro-N-quinolin-8-ylbenzamide (PubChem CID 790260) has the molecular formula C16H11FN2O and a molecular weight of 266.28 g/mol. Its IUPAC name is 4-fluoro-N-quinolin-8-ylbenzamide.

Molecular Properties

Compound Name4-fluoro-N-quinolin-8-ylbenzamide
PubChem CID790260
Molecular FormulaC16H11FN2O
Molecular Weight266.28 g/mol
Exact Mass266.09
IUPAC Name4-fluoro-N-quinolin-8-ylbenzamide
SMILESO=C(Nc1cccc2cccnc12)c1ccc(F)cc1
InChIInChI=1S/C16H11FN2O/c17-13-8-6-12(7-9-13)16(20)19-14-5-1-3-11-4-2-10-18-15(11)14/h1-10H,(H,19,20)
InChIKeyMJUMNSKVSKDCLR-UHFFFAOYSA-N
XLogP3.63
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-quinolin-8-ylbenzamide?
The IUPAC name of 4-fluoro-N-quinolin-8-ylbenzamide (CID 790260) is 4-fluoro-N-quinolin-8-ylbenzamide.
What is the SMILES notation for 4-fluoro-N-quinolin-8-ylbenzamide?
The canonical SMILES for 4-fluoro-N-quinolin-8-ylbenzamide is O=C(Nc1cccc2cccnc12)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-quinolin-8-ylbenzamide?
The InChIKey is MJUMNSKVSKDCLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O/c17-13-8-6-12(7-9-13)16(20)19-14-5-1-3-11-4-2-10-18-15(11)14/h1-10H,(H,19,20).
What are the key properties of 4-fluoro-N-quinolin-8-ylbenzamide?
4-fluoro-N-quinolin-8-ylbenzamide has a molecular weight of 266.28 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-quinolin-8-ylbenzamide is sourced from PubChem (CID 790260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).