2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone

C16H22N2O2 — CID 114337628

IUPAC2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone
SMILESO=C(CN1CCC(O)c2ccccc21)N1CCCCC1
InChIInChI=1S/C16H22N2O2/c19-15-8-11-18(14-7-3-2-6-13(14)15)12-16(20)17-9-4-1-5-10-17/h2-3,6-7,15,19H,1,4-5,8-12H2
InChIKeyFNTGHMQANQNZLW-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.94
Rot. Bonds2

About 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone

2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone (PubChem CID 114337628) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone
PubChem CID114337628
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone
SMILESO=C(CN1CCC(O)c2ccccc21)N1CCCCC1
InChIInChI=1S/C16H22N2O2/c19-15-8-11-18(14-7-3-2-6-13(14)15)12-16(20)17-9-4-1-5-10-17/h2-3,6-7,15,19H,1,4-5,8-12H2
InChIKeyFNTGHMQANQNZLW-UHFFFAOYSA-N
XLogP1.94
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-hydroxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-N-methylacetamide
CID 114338463
1-(azepan-1-yl)-2-(2,3-dihydro-1,4-benzoxazin-4-yl)ethanone
CID 110754927
N,N-diethyl-2-(5-hydroxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)acetamide
CID 104558270
2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylpropan-1-one
CID 114337576
1-benzyl-3,4-dihydro-2H-quinolin-4-ol
CID 114337756
1-(2-bromoprop-2-enyl)-2,3,4,5-tetrahydro-1-benzazepin-5-ol
CID 104558248
1-(3-pyrrolidin-1-ylpropyl)-2,3,4,5-tetrahydro-1-benzazepin-5-ol
CID 114338475
1-(2-methylsulfanylethyl)-3,4-dihydro-2H-quinolin-4-ol
CID 114337617
1-(2-methoxyethyl)-3,4-dihydro-2H-quinolin-4-ol
CID 114337638
1-(1,4-diazepan-1-yl)-2-(2,3-dihydroindol-1-yl)ethanone;dihydrochloride
CID 119417200
1-(azetidin-1-yl)-2-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)ethanone
CID 63101653
cyclohexyl-(5-hydroxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone
CID 104537371

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone (CID 114337628) is 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone is O=C(CN1CCC(O)c2ccccc21)N1CCCCC1.
What is the InChIKey of 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone?
The InChIKey is FNTGHMQANQNZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c19-15-8-11-18(14-7-3-2-6-13(14)15)12-16(20)17-9-4-1-5-10-17/h2-3,6-7,15,19H,1,4-5,8-12H2.
What are the key properties of 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone?
2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone has a molecular weight of 274.36 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-1-ylethanone is sourced from PubChem (CID 114337628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).