7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one

C17H23NO2 — CID 114940266

IUPAC7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one
SMILESCCC1CCC(Oc2ccc3c(c2)NC(=O)CC3)CC1
InChIInChI=1S/C17H23NO2/c1-2-12-3-7-14(8-4-12)20-15-9-5-13-6-10-17(19)18-16(13)11-15/h5,9,11-12,14H,2-4,6-8,10H2,1H3,(H,18,19)
InChIKeyMXEOZDJCQABOPB-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.92
Rot. Bonds3

About 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one

7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one (PubChem CID 114940266) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one
PubChem CID114940266
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC Name7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one
SMILESCCC1CCC(Oc2ccc3c(c2)NC(=O)CC3)CC1
InChIInChI=1S/C17H23NO2/c1-2-12-3-7-14(8-4-12)20-15-9-5-13-6-10-17(19)18-16(13)11-15/h5,9,11-12,14H,2-4,6-8,10H2,1H3,(H,18,19)
InChIKeyMXEOZDJCQABOPB-UHFFFAOYSA-N
XLogP3.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-cycloheptyloxy-3,4-dihydro-1H-quinolin-2-one
CID 114940056
7-(2,2-diethoxyethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114939923
7-(cyclopropylmethoxymethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 106931226
6-(4-ethylcyclohexyl)oxy-3,4-dihydro-2H-naphthalen-1-one
CID 64748496
7-(2-ethylsulfonylethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114940190
7-[(4-ethylphenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 114940161
6-piperidin-4-yloxy-1,3-dihydroindol-2-one;hydrochloride
CID 82021825
7-(2-oxopropoxy)-3,4-dihydro-1H-quinolin-2-one
CID 112704281
7-(4-methoxybutoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114940015
7-[(5-methyloxolan-2-yl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 103141087
4-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]butanal
CID 56851120
1-tert-butyl-4-(4-ethylcyclohexyl)oxybenzene
CID 64764201

Frequently Asked Questions

What is the IUPAC name of 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one (CID 114940266) is 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one is CCC1CCC(Oc2ccc3c(c2)NC(=O)CC3)CC1.
What is the InChIKey of 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is MXEOZDJCQABOPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-2-12-3-7-14(8-4-12)20-15-9-5-13-6-10-17(19)18-16(13)11-15/h5,9,11-12,14H,2-4,6-8,10H2,1H3,(H,18,19).
What are the key properties of 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one?
7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 273.38 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 114940266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).