7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one

C9H8INO2 — CID 71668438

IUPAC7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(I)c(O)cc2N1
InChIInChI=1S/C9H8INO2/c10-6-3-5-1-2-9(13)11-7(5)4-8(6)12/h3-4,12H,1-2H2,(H,11,13)
InChIKeySTMRQRQRIDHQOK-UHFFFAOYSA-N
MW289.07 g/mol
LogP1.88
Rot. Bonds

About 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one

7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one (PubChem CID 71668438) has the molecular formula C9H8INO2 and a molecular weight of 289.07 g/mol. Its IUPAC name is 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one
PubChem CID71668438
Molecular FormulaC9H8INO2
Molecular Weight289.07 g/mol
Exact Mass288.96
IUPAC Name7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(I)c(O)cc2N1
InChIInChI=1S/C9H8INO2/c10-6-3-5-1-2-9(13)11-7(5)4-8(6)12/h3-4,12H,1-2H2,(H,11,13)
InChIKeySTMRQRQRIDHQOK-UHFFFAOYSA-N
XLogP1.88
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.07
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

7-Hydroxy-3,4-dihydrocarbostyril
CID 2785758
2(1H)-Quinolone, 7-hydroxy-4-methyl-
CID 5374442
6-Hydroxy-3,4-dihydro-2(1H)-quinolinone
CID 2774040
6-hydroxy-2,3-dihydro-1H-indol-2-one
CID 2784139
N-(3-hydroxyphenyl)-2-phenylacetamide
CID 312542
7-Hydroxycarbostyril
CID 10975787
6-Hydroxy-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
CID 9942290
7-Quinolinol, 1,2,3,4-tetrahydro-
CID 93980
Mls002707319
CID 5381803
4,7-dihydroxy-3-phenyl-1H-quinolin-2-one
CID 125483873
3,4-Dihydro-5-hydroxy-2(1H)-quinolinone
CID 169153
6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one
CID 90644008

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one (CID 71668438) is 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(I)c(O)cc2N1.
What is the InChIKey of 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is STMRQRQRIDHQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8INO2/c10-6-3-5-1-2-9(13)11-7(5)4-8(6)12/h3-4,12H,1-2H2,(H,11,13).
What are the key properties of 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one?
7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 289.07 g/mol, XLogP of 1.88, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 71668438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).