7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride

C15H17ClFN3O2 — CID 119425856

IUPAC7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCNC1)c1cc(=O)[nH]c2cc(F)ccc12
InChIInChI=1S/C15H16FN3O2.ClH/c16-9-3-4-11-12(7-14(20)19-13(11)6-9)15(21)18-10-2-1-5-17-8-10;/h3-4,6-7,10,17H,1-2,5,8H2,(H,18,21)(H,19,20);1H
InChIKeyHYNQDGJTRODISA-UHFFFAOYSA-N
MW325.77 g/mol
LogP1.57
Rot. Bonds2

About 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride

7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride (PubChem CID 119425856) has the molecular formula C15H17ClFN3O2 and a molecular weight of 325.77 g/mol. Its IUPAC name is 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride
PubChem CID119425856
Molecular FormulaC15H17ClFN3O2
Molecular Weight325.77 g/mol
Exact Mass325.10
IUPAC Name7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCNC1)c1cc(=O)[nH]c2cc(F)ccc12
InChIInChI=1S/C15H16FN3O2.ClH/c16-9-3-4-11-12(7-14(20)19-13(11)6-9)15(21)18-10-2-1-5-17-8-10;/h3-4,6-7,10,17H,1-2,5,8H2,(H,18,21)(H,19,20);1H
InChIKeyHYNQDGJTRODISA-UHFFFAOYSA-N
XLogP1.57
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.77
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

7-fluoro-2-oxo-N-piperidin-4-yl-1H-quinoline-4-carboxamide
CID 119387295
2-oxo-N-[(3S)-pyrrolidin-3-yl]-1H-quinoline-4-carboxamide
CID 79687976
cis-(1S,3R)-3-[(7-fluoro-2-oxo-1H-quinoline-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120675306
4-fluoro-2-methyl-N-[(3R)-piperidin-3-yl]benzamide
CID 113436694
5-fluoro-2-(methanesulfonamido)-N-piperidin-3-ylbenzamide;hydrochloride
CID 119424450
4-(1,4-diazepane-1-carbonyl)-7-fluoro-1H-quinolin-2-one;hydrochloride
CID 119415623
7-fluoro-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]-2-oxo-1H-quinoline-4-carboxamide
CID 136514268
2-bromo-5-fluoro-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 79687966
2,3-difluoro-N-piperidin-3-ylbenzamide;hydrochloride
CID 119428838
3,4,5-trifluoro-N-piperidin-3-ylbenzamide;hydrochloride
CID 119429053
7-fluoro-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-2-oxo-1H-quinoline-4-carboxamide
CID 111696910
2-oxo-N-piperidin-3-yl-6-(trifluoromethyl)-1H-pyridine-3-carboxamide;hydrochloride
CID 119425759

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride?
The IUPAC name of 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride (CID 119425856) is 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride.
What is the SMILES notation for 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride?
The canonical SMILES for 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride is Cl.O=C(NC1CCCNC1)c1cc(=O)[nH]c2cc(F)ccc12.
What is the InChIKey of 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride?
The InChIKey is HYNQDGJTRODISA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O2.ClH/c16-9-3-4-11-12(7-14(20)19-13(11)6-9)15(21)18-10-2-1-5-17-8-10;/h3-4,6-7,10,17H,1-2,5,8H2,(H,18,21)(H,19,20);1H.
What are the key properties of 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride?
7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride has a molecular weight of 325.77 g/mol, XLogP of 1.57, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-oxo-N-piperidin-3-yl-1H-quinoline-4-carboxamide;hydrochloride is sourced from PubChem (CID 119425856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).