8-chloro-4-methyl-3H-quinolin-2-one

C10H8ClNO — CID 91844754

IUPAC8-chloro-4-methyl-3H-quinolin-2-one
SMILESCC1=c2cccc(Cl)c2=NC(=O)C1
InChIInChI=1S/C10H8ClNO/c1-6-5-9(13)12-10-7(6)3-2-4-8(10)11/h2-4H,5H2,1H3
InChIKeyHXDRDLZIVHMABR-UHFFFAOYSA-N
MW193.63 g/mol
LogP1.06
Rot. Bonds

About 8-chloro-4-methyl-3H-quinolin-2-one

8-chloro-4-methyl-3H-quinolin-2-one (PubChem CID 91844754) has the molecular formula C10H8ClNO and a molecular weight of 193.63 g/mol. Its IUPAC name is 8-chloro-4-methyl-3H-quinolin-2-one.

Molecular Properties

Compound Name8-chloro-4-methyl-3H-quinolin-2-one
PubChem CID91844754
Molecular FormulaC10H8ClNO
Molecular Weight193.63 g/mol
Exact Mass193.03
IUPAC Name8-chloro-4-methyl-3H-quinolin-2-one
SMILESCC1=c2cccc(Cl)c2=NC(=O)C1
InChIInChI=1S/C10H8ClNO/c1-6-5-9(13)12-10-7(6)3-2-4-8(10)11/h2-4H,5H2,1H3
InChIKeyHXDRDLZIVHMABR-UHFFFAOYSA-N
XLogP1.06
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.63
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-4-methyl-3H-quinolin-2-one?
The IUPAC name of 8-chloro-4-methyl-3H-quinolin-2-one (CID 91844754) is 8-chloro-4-methyl-3H-quinolin-2-one.
What is the SMILES notation for 8-chloro-4-methyl-3H-quinolin-2-one?
The canonical SMILES for 8-chloro-4-methyl-3H-quinolin-2-one is CC1=c2cccc(Cl)c2=NC(=O)C1.
What is the InChIKey of 8-chloro-4-methyl-3H-quinolin-2-one?
The InChIKey is HXDRDLZIVHMABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNO/c1-6-5-9(13)12-10-7(6)3-2-4-8(10)11/h2-4H,5H2,1H3.
What are the key properties of 8-chloro-4-methyl-3H-quinolin-2-one?
8-chloro-4-methyl-3H-quinolin-2-one has a molecular weight of 193.63 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-4-methyl-3H-quinolin-2-one is sourced from PubChem (CID 91844754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).