1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one

C22H24N2O2 — CID 53135752

IUPAC1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one
SMILESO=C(c1ccc2c(c1)CCC(=O)N2Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C22H24N2O2/c25-21-12-10-18-15-19(22(26)23-13-5-2-6-14-23)9-11-20(18)24(21)16-17-7-3-1-4-8-17/h1,3-4,7-9,11,15H,2,5-6,10,12-14,16H2
InChIKeyFNZRNNSMKLWRTB-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.79
Rot. Bonds3

About 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one

1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one (PubChem CID 53135752) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one
PubChem CID53135752
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one
SMILESO=C(c1ccc2c(c1)CCC(=O)N2Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C22H24N2O2/c25-21-12-10-18-15-19(22(26)23-13-5-2-6-14-23)9-11-20(18)24(21)16-17-7-3-1-4-8-17/h1,3-4,7-9,11,15H,2,5-6,10,12-14,16H2
InChIKeyFNZRNNSMKLWRTB-UHFFFAOYSA-N
XLogP3.79
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]pyrrolidine-2,5-dione
CID 24540069
1-methyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one
CID 52986183
2-oxo-1-(pyridin-4-ylmethyl)-3,4-dihydroquinoline-6-carboxylic acid
CID 102711258
N-[1-benzyl-6-(pyrrolidine-1-carbonyl)-3,4-dihydro-2H-quinolin-2-yl]benzenesulfonamide
CID 90807408
1-benzyl-2-oxo-3H-indole-5-carboxamide
CID 122479775
2-oxo-1-(2-pyrrolidin-1-ylethyl)-3,4-dihydroquinoline-6-carboxylic acid
CID 102711309
5-(azepane-1-carbonyl)-1-propyl-3H-indol-2-one
CID 53014656
4-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]benzamide
CID 167938471
N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-ethylbutanamide
CID 16926863
4-benzyl-2,2-dimethyl-6-(pyrrolidine-1-carbonyl)-1,4-benzoxazin-3-one
CID 1450828
4-[(3-chlorophenyl)methyl]-6-(pyrrolidine-1-carbonyl)-1,4-benzothiazin-3-one
CID 15991959
1-benzyl-6-[3-(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)propanoyl]-3,4-dihydroquinolin-2-one
CID 158430852

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one (CID 53135752) is 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one is O=C(c1ccc2c(c1)CCC(=O)N2Cc1ccccc1)N1CCCCC1.
What is the InChIKey of 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one?
The InChIKey is FNZRNNSMKLWRTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c25-21-12-10-18-15-19(22(26)23-13-5-2-6-14-23)9-11-20(18)24(21)16-17-7-3-1-4-8-17/h1,3-4,7-9,11,15H,2,5-6,10,12-14,16H2.
What are the key properties of 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one?
1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one has a molecular weight of 348.45 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 53135752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).