8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one

C14H19NO2 — CID 82174002

IUPAC8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCCc1cc(C(O)CC)cc2c1NC(=O)CC2
InChIInChI=1S/C14H19NO2/c1-3-9-7-11(12(16)4-2)8-10-5-6-13(17)15-14(9)10/h7-8,12,16H,3-6H2,1-2H3,(H,15,17)
InChIKeyUNXIVGKEJCLVDM-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.58
Rot. Bonds3

About 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one

8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 82174002) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID82174002
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCCc1cc(C(O)CC)cc2c1NC(=O)CC2
InChIInChI=1S/C14H19NO2/c1-3-9-7-11(12(16)4-2)8-10-5-6-13(17)15-14(9)10/h7-8,12,16H,3-6H2,1-2H3,(H,15,17)
InChIKeyUNXIVGKEJCLVDM-UHFFFAOYSA-N
XLogP2.58
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

8-ethyl-6-[furan-2-yl(hydroxy)methyl]-3,4-dihydro-1H-quinolin-2-one
CID 82174009
6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one
CID 19854697
6-fluoro-8-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one
CID 82174262
7-fluoro-5-(1-hydroxypropyl)-1,3-dihydroindol-2-one
CID 82173521
7-chloro-6-(1-hydroxypropyl)-8-methyl-3,4-dihydro-1H-quinolin-2-one
CID 82174111
6-(2-chloroacetyl)-8-ethyl-3,4-dihydro-1H-quinolin-2-one
CID 10911993
7-ethyl-5-(1-hydroxy-2-phenoxyethyl)-1,3-dihydroindol-2-one
CID 82172932
6-[2-(tert-butylamino)-1-hydroxyethyl]-8-chloro-3,4-dihydro-1H-quinolin-2-one;hydrochloride
CID 70510329
6-bromo-8-(1-hydroxybutyl)-3,4-dihydro-1H-quinolin-2-one
CID 82174296
7-ethyl-5-[hydroxy-(2-methylphenyl)methyl]-1,3-dihydroindol-2-one
CID 82172917
6-(1-hydroxybutan-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 116964107
6-bromo-8-(1-hydroxy-2-methoxyethyl)-3,4-dihydro-1H-quinolin-2-one
CID 82174297

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one (CID 82174002) is 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one is CCc1cc(C(O)CC)cc2c1NC(=O)CC2.
What is the InChIKey of 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is UNXIVGKEJCLVDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-3-9-7-11(12(16)4-2)8-10-5-6-13(17)15-14(9)10/h7-8,12,16H,3-6H2,1-2H3,(H,15,17).
What are the key properties of 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one?
8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 233.31 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 82174002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).