6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide

C15H15FN2O2 — CID 166186547

IUPAC6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide
SMILESO=C(NC1CCOCC1)c1cnc2ccc(F)cc2c1
InChIInChI=1S/C15H15FN2O2/c16-12-1-2-14-10(8-12)7-11(9-17-14)15(19)18-13-3-5-20-6-4-13/h1-2,7-9,13H,3-6H2,(H,18,19)
InChIKeyGMGVIASNJVWXCF-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.28
Rot. Bonds2

About 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide

6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide (PubChem CID 166186547) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide
PubChem CID166186547
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide
SMILESO=C(NC1CCOCC1)c1cnc2ccc(F)cc2c1
InChIInChI=1S/C15H15FN2O2/c16-12-1-2-14-10(8-12)7-11(9-17-14)15(19)18-13-3-5-20-6-4-13/h1-2,7-9,13H,3-6H2,(H,18,19)
InChIKeyGMGVIASNJVWXCF-UHFFFAOYSA-N
XLogP2.28
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-6-hydroxyquinoline-3-carboxamide
CID 69292752
6-fluoroquinoline-3-carbohydrazide
CID 119026646
7-fluoro-N-(4-methylcyclohexyl)quinoline-3-carboxamide
CID 22136439
6-fluoro-N-(2-morpholin-4-yl-2-oxoethyl)quinoline-3-carboxamide
CID 146126137
6-fluoro-N-[1-(2-methoxyethyl)piperidin-3-yl]quinoline-3-carboxamide
CID 75391136
cyclopropyl-(6-fluoroquinolin-3-yl)methanone
CID 134393278
2-[(6-fluoroquinoline-3-carbonyl)amino]acetic acid
CID 110489772
6-fluoro-N-(4-methylphenyl)quinoline-3-carboxamide
CID 110489843
3-(oxan-4-ylcarbamoyl)benzoic acid
CID 43610555
6-fluoro-N-[2-[(2S)-2-methylpiperidin-1-yl]ethyl]quinoline-3-carboxamide
CID 164633773
(6-fluoroquinolin-3-yl)-[2-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 166186679
3-(oxolan-3-ylamino)quinolin-6-ol
CID 89443563

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide?
The IUPAC name of 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide (CID 166186547) is 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide?
The canonical SMILES for 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide is O=C(NC1CCOCC1)c1cnc2ccc(F)cc2c1.
What is the InChIKey of 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide?
The InChIKey is GMGVIASNJVWXCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c16-12-1-2-14-10(8-12)7-11(9-17-14)15(19)18-13-3-5-20-6-4-13/h1-2,7-9,13H,3-6H2,(H,18,19).
What are the key properties of 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide?
6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide has a molecular weight of 274.30 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(oxan-4-yl)quinoline-3-carboxamide is sourced from PubChem (CID 166186547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).