N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide

C17H20N4O — CID 49431443

IUPACN-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide
SMILESO=C(NC1CC1)C1CCCN(c2cnc3ccccc3n2)C1
InChIInChI=1S/C17H20N4O/c22-17(19-13-7-8-13)12-4-3-9-21(11-12)16-10-18-14-5-1-2-6-15(14)20-16/h1-2,5-6,10,12-13H,3-4,7-9,11H2,(H,19,22)
InChIKeyZAWGILGNKLTTHS-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.12
Rot. Bonds3

About N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide

N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide (PubChem CID 49431443) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide
PubChem CID49431443
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide
SMILESO=C(NC1CC1)C1CCCN(c2cnc3ccccc3n2)C1
InChIInChI=1S/C17H20N4O/c22-17(19-13-7-8-13)12-4-3-9-21(11-12)16-10-18-14-5-1-2-6-15(14)20-16/h1-2,5-6,10,12-13H,3-4,7-9,11H2,(H,19,22)
InChIKeyZAWGILGNKLTTHS-UHFFFAOYSA-N
XLogP2.12
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-quinoxalin-2-ylpiperidin-3-yl)cyclopropanecarboxamide
CID 155975943
(3S)-N-cyclopropyl-1-(1-quinoxalin-2-ylpiperidin-4-yl)piperidine-3-carboxamide
CID 95550020
N-(2,6-dimethylphenyl)-1-quinoxalin-2-ylpiperidine-3-carboxamide
CID 46354237
(3S)-N-(3-chlorophenyl)-1-quinoxalin-2-ylpiperidine-3-carboxamide
CID 92726481
N-(4-propan-2-ylphenyl)-1-quinoxalin-2-ylpiperidine-3-carboxamide
CID 16875992
(3S)-N-[(4-chlorophenyl)methyl]-1-quinoxalin-2-ylpiperidine-3-carboxamide
CID 42584756
(3S)-N-[(2R)-4-phenylbutan-2-yl]-1-quinoxalin-2-ylpiperidine-3-carboxamide
CID 41015611
1-quinoxalin-2-ylazepane-4-carboxylic acid
CID 139695402
N-cycloheptyl-1-(2-phenylpyrimidin-4-yl)piperidine-3-carboxamide
CID 53071425
(4,4-difluoropiperidin-1-yl)-(1-quinoxalin-2-ylpiperidin-3-yl)methanone
CID 163354765
N-cyclohexyl-1-(3-ethoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 50752811
(3R)-N-cyclopropyl-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 6557829

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide (CID 49431443) is N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide is O=C(NC1CC1)C1CCCN(c2cnc3ccccc3n2)C1.
What is the InChIKey of N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide?
The InChIKey is ZAWGILGNKLTTHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c22-17(19-13-7-8-13)12-4-3-9-21(11-12)16-10-18-14-5-1-2-6-15(14)20-16/h1-2,5-6,10,12-13H,3-4,7-9,11H2,(H,19,22).
What are the key properties of N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide?
N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 49431443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).