2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

C17H25N3O2 — CID 119558878

IUPAC2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESO=C(NCCC1CCCNC1)c1cc2c([nH]c1=O)CCCC2
InChIInChI=1S/C17H25N3O2/c21-16(19-9-7-12-4-3-8-18-11-12)14-10-13-5-1-2-6-15(13)20-17(14)22/h10,12,18H,1-9,11H2,(H,19,21)(H,20,22)
InChIKeyLOHQFECVDFYWHD-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.37
Rot. Bonds4

About 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (PubChem CID 119558878) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
PubChem CID119558878
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESO=C(NCCC1CCCNC1)c1cc2c([nH]c1=O)CCCC2
InChIInChI=1S/C17H25N3O2/c21-16(19-9-7-12-4-3-8-18-11-12)14-10-13-5-1-2-6-15(13)20-17(14)22/h10,12,18H,1-9,11H2,(H,19,21)(H,20,22)
InChIKeyLOHQFECVDFYWHD-UHFFFAOYSA-N
XLogP1.37
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide with MolForge

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Related Compounds

2-oxo-N-(piperidin-3-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
CID 119463989
N-[2-(cycloheptylamino)ethyl]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
CID 119621149
2-oxo-N-(3-piperazin-1-ylpropyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide;hydrochloride
CID 119394055
5-bromo-2-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 65311677
5-fluoro-2-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 55144401
2,3,4-trifluoro-N-(2-piperidin-3-ylethyl)benzamide
CID 79749359
2-oxo-N-(2-piperidin-3-ylethyl)-1H-pyridine-4-carboxamide
CID 103806761
4-fluoro-2-iodo-N-(2-piperidin-3-ylethyl)benzamide
CID 103806776
2-chloro-4-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 106862146
2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554934
2,3,5,6-tetrafluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555428
N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide
CID 60895336

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The IUPAC name of 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (CID 119558878) is 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.
What is the SMILES notation for 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The canonical SMILES for 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is O=C(NCCC1CCCNC1)c1cc2c([nH]c1=O)CCCC2.
What is the InChIKey of 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The InChIKey is LOHQFECVDFYWHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c21-16(19-9-7-12-4-3-8-18-11-12)14-10-13-5-1-2-6-15(13)20-17(14)22/h10,12,18H,1-9,11H2,(H,19,21)(H,20,22).
What are the key properties of 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide has a molecular weight of 303.41 g/mol, XLogP of 1.37, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(2-piperidin-3-ylethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is sourced from PubChem (CID 119558878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).