6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane

C11H14ClNO — CID 144928829

IUPAC6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane
SMILESCC.Cc1cc2c(cc1Cl)NC(=O)C2
InChIInChI=1S/C9H8ClNO.C2H6/c1-5-2-6-3-9(12)11-8(6)4-7(5)10;1-2/h2,4H,3H2,1H3,(H,11,12);1-2H3
InChIKeyGGBPXTFIWRERQV-UHFFFAOYSA-N
MW211.69 g/mol
LogP3.17
Rot. Bonds

About 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane

6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane (PubChem CID 144928829) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane.

Molecular Properties

Compound Name6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane
PubChem CID144928829
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane
SMILESCC.Cc1cc2c(cc1Cl)NC(=O)C2
InChIInChI=1S/C9H8ClNO.C2H6/c1-5-2-6-3-9(12)11-8(6)4-7(5)10;1-2/h2,4H,3H2,1H3,(H,11,12);1-2H3
InChIKeyGGBPXTFIWRERQV-UHFFFAOYSA-N
XLogP3.17
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-chloro-5-(3,4-dimethylphenyl)-1,3-dihydroindol-2-one
CID 144760752
5-[amino-(3-chloro-4-methylphenyl)methyl]-6-chloro-1,3-dihydroindol-2-one
CID 63194843
5-[(1S)-1-aminoethyl]-6-chloro-1,3-dihydroindol-2-one
CID 82758304
5-(2-bromoacetyl)-6-chloro-1,3-dihydroindol-2-one
CID 10541398
6-chloro-5-(1-hydroxy-2-methylpropyl)-1,3-dihydroindol-2-one
CID 61081464
6-chloro-5-(2-chloro-4-methylbenzoyl)-1,3-dihydroindol-2-one
CID 106860794
ethane;5-methyl-1,3-dihydroindol-2-one
CID 91234498
6-chloro-5-(propylamino)-1,3-dihydroindol-2-one
CID 43691797
N-(5-methyl-2-oxo-1,3-dihydroindol-6-yl)formamide
CID 23439064
6-chloro-N-(3,4-dimethylphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 44634854
5-(5-bromo-4-methylthiophene-2-carbonyl)-6-chloro-1,3-dihydroindol-2-one
CID 79981558
6-chloro-5-[(4-fluoro-3-methylphenyl)-hydroxymethyl]-1,3-dihydroindol-2-one
CID 63210472

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane?
The IUPAC name of 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane (CID 144928829) is 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane.
What is the SMILES notation for 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane?
The canonical SMILES for 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane is CC.Cc1cc2c(cc1Cl)NC(=O)C2.
What is the InChIKey of 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane?
The InChIKey is GGBPXTFIWRERQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClNO.C2H6/c1-5-2-6-3-9(12)11-8(6)4-7(5)10;1-2/h2,4H,3H2,1H3,(H,11,12);1-2H3.
What are the key properties of 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane?
6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane has a molecular weight of 211.69 g/mol, XLogP of 3.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane is sourced from PubChem (CID 144928829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).