(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone

C16H22N2O2 — CID 79159866

IUPAC(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)N2CCCc3cccc(O)c32)CC1
InChIInChI=1S/C16H22N2O2/c1-12-7-10-17(11-8-12)16(20)18-9-3-5-13-4-2-6-14(19)15(13)18/h2,4,6,12,19H,3,5,7-11H2,1H3
InChIKeyIYCATZVUXCHWQD-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.00
Rot. Bonds

About (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone

(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone (PubChem CID 79159866) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone
PubChem CID79159866
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)N2CCCc3cccc(O)c32)CC1
InChIInChI=1S/C16H22N2O2/c1-12-7-10-17(11-8-12)16(20)18-9-3-5-13-4-2-6-14(19)15(13)18/h2,4,6,12,19H,3,5,7-11H2,1H3
InChIKeyIYCATZVUXCHWQD-UHFFFAOYSA-N
XLogP3.00
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dihydro-2H-quinolin-1-yl-(4-methylpiperidin-1-yl)methanone
CID 108987982
1-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)but-2-yn-1-one
CID 106741641
(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-phenylmethanone
CID 15267724
N,N-diethyl-8-hydroxy-3,4-dihydro-2H-quinoline-1-carboxamide
CID 79161867
[6-(3,4-dihydro-2H-quinoline-1-carbonyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 109095477
1-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-2-methylsulfonylpropan-1-one
CID 115970115
1-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-2-propan-2-yloxyethanone
CID 112602907
(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylthiophen-3-yl)methanone
CID 79807986
1-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-2-(4-hydroxyphenyl)ethanone
CID 63214929
1-(3,4-dihydro-2H-quinoline-1-carbonyl)piperidine-4-carboxylic acid
CID 28513192
2-bicyclo[2.2.1]hept-5-enyl-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 63215258
(4-cyclopropyl-1,3-thiazol-5-yl)-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 75473113

Frequently Asked Questions

What is the IUPAC name of (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone (CID 79159866) is (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone is CC1CCN(C(=O)N2CCCc3cccc(O)c32)CC1.
What is the InChIKey of (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone?
The InChIKey is IYCATZVUXCHWQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12-7-10-17(11-8-12)16(20)18-9-3-5-13-4-2-6-14(19)15(13)18/h2,4,6,12,19H,3,5,7-11H2,1H3.
What are the key properties of (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone?
(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone has a molecular weight of 274.36 g/mol, XLogP of 3.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 79159866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).