6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one

C12H13NO2 — CID 169453981

IUPAC6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(C=CCO)ccc2N1
InChIInChI=1S/C12H13NO2/c14-7-1-2-9-3-5-11-10(8-9)4-6-12(15)13-11/h1-3,5,8,14H,4,6-7H2,(H,13,15)
InChIKeyVIXHQRRAIZROJY-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.58
Rot. Bonds2

About 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one

6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 169453981) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID169453981
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(C=CCO)ccc2N1
InChIInChI=1S/C12H13NO2/c14-7-1-2-9-3-5-11-10(8-9)4-6-12(15)13-11/h1-3,5,8,14H,4,6-7H2,(H,13,15)
InChIKeyVIXHQRRAIZROJY-UHFFFAOYSA-N
XLogP1.58
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-(4-bromobut-1-enyl)-3,4-dihydro-1H-quinolin-2-one
CID 170498191
6-[4-[4-(3-chlorophenyl)piperazin-1-yl]but-1-enyl]-3,4-dihydro-1H-quinolin-2-one
CID 54568797
6-[(E)-3-(4-benzylpiperidin-1-yl)prop-1-enyl]-3,4-dihydro-1H-quinolin-2-one
CID 13120862
(2-oxo-3,4-dihydro-1H-quinolin-6-yl)boronic acid
CID 59763201
3-(1,2,3,4-tetrahydroisoquinolin-7-yl)prop-2-en-1-ol
CID 169453485
6-chloro-3,4-dihydro-1H-quinolin-2-one
CID 11240825
6-(1-hydroxybutan-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 116964107
N-[2-methyl-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)propyl]acetamide
CID 115191431
(E)-5-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)pent-2-enoic acid
CID 116865917
6-[(1S)-2-chloro-1-hydroxyethyl]-3,4-dihydro-1H-quinolin-2-one
CID 69453325
6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one
CID 19854697
6-(2-bromoethyl)-3,4-dihydro-1H-quinolin-2-one
CID 18382037

Frequently Asked Questions

What is the IUPAC name of 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one (CID 169453981) is 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(C=CCO)ccc2N1.
What is the InChIKey of 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is VIXHQRRAIZROJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c14-7-1-2-9-3-5-11-10(8-9)4-6-12(15)13-11/h1-3,5,8,14H,4,6-7H2,(H,13,15).
What are the key properties of 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one?
6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 203.24 g/mol, XLogP of 1.58, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-hydroxyprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 169453981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).