N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide

C17H23N3O2 — CID 119292758

IUPACN-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide
SMILESCC(NC(=O)C1CCCCN1)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C17H23N3O2/c1-11(19-17(22)15-4-2-3-9-18-15)12-5-7-14-13(10-12)6-8-16(21)20-14/h5,7,10-11,15,18H,2-4,6,8-9H2,1H3,(H,19,22)(H,20,21)
InChIKeyJTICZWAIBZRQRA-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.89
Rot. Bonds3

About N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide

N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide (PubChem CID 119292758) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide
PubChem CID119292758
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide
SMILESCC(NC(=O)C1CCCCN1)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C17H23N3O2/c1-11(19-17(22)15-4-2-3-9-18-15)12-5-7-14-13(10-12)6-8-16(21)20-14/h5,7,10-11,15,18H,2-4,6,8-9H2,1H3,(H,19,22)(H,20,21)
InChIKeyJTICZWAIBZRQRA-UHFFFAOYSA-N
XLogP1.89
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119729826
3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide
CID 119729790
N-[(1S)-1-(4-methylphenyl)ethyl]piperidine-2-carboxamide
CID 81355602
(2S)-N-[1-(4-fluorophenyl)ethyl]piperidine-2-carboxamide
CID 75495928
(2R)-N-[(1R)-1-(3-bromophenyl)ethyl]piperidine-2-carboxamide
CID 104914374
N-[1-(3,4-difluorophenyl)ethyl]piperidine-2-carboxamide;hydrochloride
CID 119269548
3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119729792
(2R)-N-[1-(4-bromophenyl)ethyl]piperidine-2-carboxamide
CID 103809894
N-[1-(1,3-benzodioxol-5-yl)ethyl]piperidine-2-carboxamide
CID 43704400
N-[(1R)-1-(3-bromophenyl)ethyl]azepane-2-carboxamide
CID 81375889
N-[(1S)-1-phenylethyl]piperidine-2-carboxamide
CID 15445575
(3R)-3-cyclopropyl-N-[(1R)-1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]butanamide
CID 97314500

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide?
The IUPAC name of N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide (CID 119292758) is N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide?
The canonical SMILES for N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide is CC(NC(=O)C1CCCCN1)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide?
The InChIKey is JTICZWAIBZRQRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-11(19-17(22)15-4-2-3-9-18-15)12-5-7-14-13(10-12)6-8-16(21)20-14/h5,7,10-11,15,18H,2-4,6,8-9H2,1H3,(H,19,22)(H,20,21).
What are the key properties of N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide?
N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 1.89, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 119292758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).