4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one

C10H11NO2 — CID 143863556

IUPAC4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one
SMILESCC1=CC2C(O)=CC(=O)NC2C=C1
InChIInChI=1S/C10H11NO2/c1-6-2-3-8-7(4-6)9(12)5-10(13)11-8/h2-5,7-8,12H,1H3,(H,11,13)
InChIKeyTVMXFSMNTKUOQQ-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.06
Rot. Bonds

About 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one

4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one (PubChem CID 143863556) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one
PubChem CID143863556
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one
SMILESCC1=CC2C(O)=CC(=O)NC2C=C1
InChIInChI=1S/C10H11NO2/c1-6-2-3-8-7(4-6)9(12)5-10(13)11-8/h2-5,7-8,12H,1H3,(H,11,13)
InChIKeyTVMXFSMNTKUOQQ-UHFFFAOYSA-N
XLogP1.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-hydroxy-6-methyl-4a,8a-dihydrochromen-2-one
CID 134291801
7-methyl-4a,8a-dihydro-1H-quinolin-2-one
CID 89245804
(2R)-2-ethyl-3-hydroxy-1,2-dihydropyrrol-5-one
CID 138579820
5-methyl-3a,7a-dihydro-1H-indole
CID 59013901
(1R,2S)-4-methylcyclohexa-3,5-diene-1,2-diol
CID 25203479
(2R)-2-hydroxy-3-methyl-1,2-dihydropyrrol-5-one
CID 162893056
ethane;6-methyl-3a,7a-dihydro-3H-1,3-benzothiazole-2-thione
CID 143778536
4-hexyl-7-methoxy-4a,8a-dihydro-1H-quinolin-2-one
CID 123299008
6-amino-4a,8a-dihydro-1H-quinolin-2-one
CID 163515053
(1R,2S)-4-methylcyclohexa-3,5-diene-1,2-dicarboxylic acid
CID 175022944
5-methyl-1,3,3a,7a-tetrahydroinden-2-one
CID 58169662
3-ethyl-2-hydroxy-1,2-dihydropyrrol-5-one
CID 135265082

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one?
The IUPAC name of 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one (CID 143863556) is 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one?
The canonical SMILES for 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one is CC1=CC2C(O)=CC(=O)NC2C=C1.
What is the InChIKey of 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one?
The InChIKey is TVMXFSMNTKUOQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-6-2-3-8-7(4-6)9(12)5-10(13)11-8/h2-5,7-8,12H,1H3,(H,11,13).
What are the key properties of 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one?
4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one has a molecular weight of 177.20 g/mol, XLogP of 1.06, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methyl-4a,8a-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 143863556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).