8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one

C10H8ClNO2 — CID 164656985

IUPAC8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one
SMILESCc1ccc(Cl)c2[nH]c(=O)cc(O)c12
InChIInChI=1S/C10H8ClNO2/c1-5-2-3-6(11)10-9(5)7(13)4-8(14)12-10/h2-4H,1H3,(H2,12,13,14)
InChIKeyAMCAQYNKSBRVRT-UHFFFAOYSA-N
MW209.63 g/mol
LogP2.20
Rot. Bonds

About 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one

8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one (PubChem CID 164656985) has the molecular formula C10H8ClNO2 and a molecular weight of 209.63 g/mol. Its IUPAC name is 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one.

Molecular Properties

Compound Name8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one
PubChem CID164656985
Molecular FormulaC10H8ClNO2
Molecular Weight209.63 g/mol
Exact Mass209.02
IUPAC Name8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one
SMILESCc1ccc(Cl)c2[nH]c(=O)cc(O)c12
InChIInChI=1S/C10H8ClNO2/c1-5-2-3-6(11)10-9(5)7(13)4-8(14)12-10/h2-4H,1H3,(H2,12,13,14)
InChIKeyAMCAQYNKSBRVRT-UHFFFAOYSA-N
XLogP2.20
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.63
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one?
The IUPAC name of 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one (CID 164656985) is 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one.
What is the SMILES notation for 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one?
The canonical SMILES for 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one is Cc1ccc(Cl)c2[nH]c(=O)cc(O)c12.
What is the InChIKey of 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one?
The InChIKey is AMCAQYNKSBRVRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNO2/c1-5-2-3-6(11)10-9(5)7(13)4-8(14)12-10/h2-4H,1H3,(H2,12,13,14).
What are the key properties of 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one?
8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one has a molecular weight of 209.63 g/mol, XLogP of 2.20, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one is sourced from PubChem (CID 164656985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).