6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one

C10H10ClNO — CID 10821699

IUPAC6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one
SMILESCC1Cc2cc(Cl)ccc2NC1=O
InChIInChI=1S/C10H10ClNO/c1-6-4-7-5-8(11)2-3-9(7)12-10(6)13/h2-3,5-6H,4H2,1H3,(H,12,13)
InChIKeyKZUUDKWKWNWYAX-UHFFFAOYSA-N
MW195.65 g/mol
LogP2.47
Rot. Bonds

About 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one

6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one (PubChem CID 10821699) has the molecular formula C10H10ClNO and a molecular weight of 195.65 g/mol. Its IUPAC name is 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one
PubChem CID10821699
Molecular FormulaC10H10ClNO
Molecular Weight195.65 g/mol
Exact Mass195.05
IUPAC Name6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one
SMILESCC1Cc2cc(Cl)ccc2NC1=O
InChIInChI=1S/C10H10ClNO/c1-6-4-7-5-8(11)2-3-9(7)12-10(6)13/h2-3,5-6H,4H2,1H3,(H,12,13)
InChIKeyKZUUDKWKWNWYAX-UHFFFAOYSA-N
XLogP2.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one (CID 10821699) is 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one is CC1Cc2cc(Cl)ccc2NC1=O.
What is the InChIKey of 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is KZUUDKWKWNWYAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClNO/c1-6-4-7-5-8(11)2-3-9(7)12-10(6)13/h2-3,5-6H,4H2,1H3,(H,12,13).
What are the key properties of 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one?
6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 195.65 g/mol, XLogP of 2.47, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-methyl-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 10821699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).