6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one

C16H22N2O — CID 116925681

IUPAC6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(CCC3CCNCC3)ccc2N1
InChIInChI=1S/C16H22N2O/c19-16-6-4-14-11-13(3-5-15(14)18-16)2-1-12-7-9-17-10-8-12/h3,5,11-12,17H,1-2,4,6-10H2,(H,18,19)
InChIKeyQHZLXEHKPBBHAV-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.50
Rot. Bonds3

About 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one

6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 116925681) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID116925681
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(CCC3CCNCC3)ccc2N1
InChIInChI=1S/C16H22N2O/c19-16-6-4-14-11-13(3-5-15(14)18-16)2-1-12-7-9-17-10-8-12/h3,5,11-12,17H,1-2,4,6-10H2,(H,18,19)
InChIKeyQHZLXEHKPBBHAV-UHFFFAOYSA-N
XLogP2.50
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-(piperidin-4-ylmethyl)-3,4-dihydro-1H-quinolin-2-one
CID 82232043
5-(2-piperidin-4-ylethyl)-2,3-dihydro-1H-indole
CID 116998012
6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline
CID 116997911
6-(2-bromoethyl)-3,4-dihydro-1H-quinolin-2-one
CID 18382037
6-(2-sulfanylethyl)-3,4-dihydro-1H-quinolin-2-one
CID 82283516
5-(piperidin-4-ylmethyl)-1,3-dihydroindol-2-one
CID 82231323
6-[2-(azetidin-3-ylmethylamino)ethyl]-3,4-dihydro-1H-quinolin-2-one
CID 115207782
6-[(pyrrolidin-3-ylamino)methyl]-3,4-dihydro-1H-quinolin-2-one
CID 115118827
6-[[methyl(pyrrolidin-3-yl)amino]methyl]-3,4-dihydro-1H-quinolin-2-one
CID 115118915
6-[2-(methylamino)ethyl]-3,4-dihydro-1H-quinolin-2-one
CID 82282846
2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethanesulfonyl chloride
CID 82488863
N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopropanecarboxamide
CID 110788608

Frequently Asked Questions

What is the IUPAC name of 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one (CID 116925681) is 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(CCC3CCNCC3)ccc2N1.
What is the InChIKey of 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is QHZLXEHKPBBHAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c19-16-6-4-14-11-13(3-5-15(14)18-16)2-1-12-7-9-17-10-8-12/h3,5,11-12,17H,1-2,4,6-10H2,(H,18,19).
What are the key properties of 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one?
6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 258.37 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 116925681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).