7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one

C15H16ClNO2 — CID 54737097

IUPAC7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2c(O)c1C1CCCCC1
InChIInChI=1S/C15H16ClNO2/c16-10-6-7-11-12(8-10)17-15(19)13(14(11)18)9-4-2-1-3-5-9/h6-9H,1-5H2,(H2,17,18,19)
InChIKeyCYZMRBBARSXFQH-UHFFFAOYSA-N
MW277.75 g/mol
LogP3.93
Rot. Bonds1

About 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one

7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one (PubChem CID 54737097) has the molecular formula C15H16ClNO2 and a molecular weight of 277.75 g/mol. Its IUPAC name is 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one.

Molecular Properties

Compound Name7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one
PubChem CID54737097
Molecular FormulaC15H16ClNO2
Molecular Weight277.75 g/mol
Exact Mass277.09
IUPAC Name7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2c(O)c1C1CCCCC1
InChIInChI=1S/C15H16ClNO2/c16-10-6-7-11-12(8-10)17-15(19)13(14(11)18)9-4-2-1-3-5-9/h6-9H,1-5H2,(H2,17,18,19)
InChIKeyCYZMRBBARSXFQH-UHFFFAOYSA-N
XLogP3.93
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.75
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one?
The IUPAC name of 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one (CID 54737097) is 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one.
What is the SMILES notation for 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one?
The canonical SMILES for 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one is O=c1[nH]c2cc(Cl)ccc2c(O)c1C1CCCCC1.
What is the InChIKey of 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one?
The InChIKey is CYZMRBBARSXFQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO2/c16-10-6-7-11-12(8-10)17-15(19)13(14(11)18)9-4-2-1-3-5-9/h6-9H,1-5H2,(H2,17,18,19).
What are the key properties of 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one?
7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one has a molecular weight of 277.75 g/mol, XLogP of 3.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-cyclohexyl-4-hydroxy-1H-quinolin-2-one is sourced from PubChem (CID 54737097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).