3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one

C15H19NO — CID 82081633

IUPAC3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one
SMILESCc1cccc2c1NC(=O)C2C1CCCCC1
InChIInChI=1S/C15H19NO/c1-10-6-5-9-12-13(15(17)16-14(10)12)11-7-3-2-4-8-11/h5-6,9,11,13H,2-4,7-8H2,1H3,(H,16,17)
InChIKeyJSPKRCCJVACLPQ-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.61
Rot. Bonds1

About 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one

3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one (PubChem CID 82081633) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one
PubChem CID82081633
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one
SMILESCc1cccc2c1NC(=O)C2C1CCCCC1
InChIInChI=1S/C15H19NO/c1-10-6-5-9-12-13(15(17)16-14(10)12)11-7-3-2-4-8-11/h5-6,9,11,13H,2-4,7-8H2,1H3,(H,16,17)
InChIKeyJSPKRCCJVACLPQ-UHFFFAOYSA-N
XLogP3.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-cyclohexylethyl)-7-methyl-1,3-dihydroindol-2-one
CID 106987031
7-fluoro-3-(4-methylcyclohexyl)-1,3-dihydroindol-2-one
CID 106986686
6-bromo-3-cyclohexyl-1,3-dihydroindol-2-one
CID 83853500
7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one
CID 84631458
6-methyl-1,8-diazatricyclo[8.6.0.02,7]hexadeca-2,4,6-trien-9-one
CID 114240010
3-(1-adamantyl)-7-methyl-1,3-dihydroindol-2-one
CID 106986659
7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one
CID 115001699
7-methyl-3-pentan-3-yl-1,3-dihydroindol-2-one
CID 106986723
3-(3-methylcyclopentyl)-7-(trifluoromethoxy)-1,3-dihydroindol-2-one
CID 106986949
(2,3-dimethylphenyl)cyclodecane
CID 21161883
3-anilino-7-methyl-1,3-dihydroindol-2-one
CID 114996622
7-methyl-3-[(2,4,5-trimethoxyphenyl)methyl]-1,3-dihydroindol-2-one
CID 43912363

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one?
The IUPAC name of 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one (CID 82081633) is 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one?
The canonical SMILES for 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one is Cc1cccc2c1NC(=O)C2C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one?
The InChIKey is JSPKRCCJVACLPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-10-6-5-9-12-13(15(17)16-14(10)12)11-7-3-2-4-8-11/h5-6,9,11,13H,2-4,7-8H2,1H3,(H,16,17).
What are the key properties of 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one?
3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one has a molecular weight of 229.32 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one is sourced from PubChem (CID 82081633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).