N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide

C16H19N3O2 — CID 114695048

IUPACN-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide
SMILESCC1NCCCC1NC(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C16H19N3O2/c1-10-13(7-4-8-17-10)19-16(21)12-9-15(20)18-14-6-3-2-5-11(12)14/h2-3,5-6,9-10,13,17H,4,7-8H2,1H3,(H,18,20)(H,19,21)
InChIKeyLEVZVEPAYSMCNT-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.40
Rot. Bonds2

About N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide

N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 114695048) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide
PubChem CID114695048
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide
SMILESCC1NCCCC1NC(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C16H19N3O2/c1-10-13(7-4-8-17-10)19-16(21)12-9-15(20)18-14-6-3-2-5-11(12)14/h2-3,5-6,9-10,13,17H,4,7-8H2,1H3,(H,18,20)(H,19,21)
InChIKeyLEVZVEPAYSMCNT-UHFFFAOYSA-N
XLogP1.40
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpiperidin-3-yl)-1H-indole-3-carboxamide
CID 114694981
trans-(1S,2S)-2-[(2-oxo-1H-quinoline-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 124703895
N-(2-aminocyclohexyl)-2-oxo-1H-quinoline-4-carboxamide
CID 61038006
N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 120574115
N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride
CID 120574114
2-oxo-N-[(3S)-pyrrolidin-3-yl]-1H-quinoline-4-carboxamide
CID 79687976
N-[(2R,3R)-2-methylpiperidin-3-yl]benzamide
CID 124511336
N-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1H-quinoline-4-carboxamide
CID 10086797
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-oxo-1H-quinoline-4-carboxamide;hydrochloride
CID 119457477
2,3-dimethyl-N-(2-methylpiperidin-3-yl)benzamide
CID 79042389
5-chloro-2-iodo-N-(2-methylpiperidin-3-yl)benzamide
CID 106813444
2-oxo-1H-quinoline-4-carbohydrazide
CID 676699

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide (CID 114695048) is N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide is CC1NCCCC1NC(=O)c1cc(=O)[nH]c2ccccc12.
What is the InChIKey of N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is LEVZVEPAYSMCNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10-13(7-4-8-17-10)19-16(21)12-9-15(20)18-14-6-3-2-5-11(12)14/h2-3,5-6,9-10,13,17H,4,7-8H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide?
N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.40, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 114695048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).