1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one

C23H28N2O — CID 152744549

IUPAC1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one
SMILESCC(c1ccccc1)C(C1CCCNC1)N1C(=O)CCc2ccccc21
InChIInChI=1S/C23H28N2O/c1-17(18-8-3-2-4-9-18)23(20-11-7-15-24-16-20)25-21-12-6-5-10-19(21)13-14-22(25)26/h2-6,8-10,12,17,20,23-24H,7,11,13-16H2,1H3
InChIKeyQJABLZYJFKQEQG-UHFFFAOYSA-N
MW348.49 g/mol
LogP4.14
Rot. Bonds4

About 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one

1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one (PubChem CID 152744549) has the molecular formula C23H28N2O and a molecular weight of 348.49 g/mol. Its IUPAC name is 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one
PubChem CID152744549
Molecular FormulaC23H28N2O
Molecular Weight348.49 g/mol
Exact Mass348.22
IUPAC Name1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one
SMILESCC(c1ccccc1)C(C1CCCNC1)N1C(=O)CCc2ccccc21
InChIInChI=1S/C23H28N2O/c1-17(18-8-3-2-4-9-18)23(20-11-7-15-24-16-20)25-21-12-6-5-10-19(21)13-14-22(25)26/h2-6,8-10,12,17,20,23-24H,7,11,13-16H2,1H3
InChIKeyQJABLZYJFKQEQG-UHFFFAOYSA-N
XLogP4.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.49
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-phenyl-[(3S)-piperidin-3-yl]methanol
CID 39238461
N-[3-(2,3-dihydroindol-1-yl)propyl]-3-piperidin-3-ylbutanamide
CID 119851195
4-(1-piperidin-3-ylethyl)thiomorpholine-3,5-dione
CID 104570979
N-[3-(2,3-dihydroindol-1-yl)propyl]-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119851194
1-(1-piperidin-3-ylethyl)piperidin-2-one
CID 43523151
3-(1-piperidin-3-ylethyl)-8-oxa-3-azabicyclo[3.2.1]octane-2,4-dione
CID 102689745
1-(3-oxopentan-2-yl)-3,4-dihydroquinolin-2-one
CID 64865861
1-(1-phenylethyl)-3-[(3S)-piperidin-3-yl]imidazolidin-2-one
CID 138622014
2-phenyl-N-[(3S)-piperidin-3-yl]propane-1-sulfonamide
CID 104982520
3-(3-piperidin-3-ylbutyl)-1,2,4,5-tetrahydro-3-benzazepine
CID 81048505
3-(1-piperidin-3-ylethyl)-3-azaspiro[5.5]undecane-2,4-dione
CID 43804792
(2S)-N-cyclopentyl-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanamide
CID 92886787

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one (CID 152744549) is 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one is CC(c1ccccc1)C(C1CCCNC1)N1C(=O)CCc2ccccc21.
What is the InChIKey of 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one?
The InChIKey is QJABLZYJFKQEQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O/c1-17(18-8-3-2-4-9-18)23(20-11-7-15-24-16-20)25-21-12-6-5-10-19(21)13-14-22(25)26/h2-6,8-10,12,17,20,23-24H,7,11,13-16H2,1H3.
What are the key properties of 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one?
1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one has a molecular weight of 348.49 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenyl-1-piperidin-3-ylpropyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 152744549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).