7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one

C15H18ClNO — CID 106986742

IUPAC7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one
SMILESCC1(C2C(=O)Nc3c(Cl)cccc32)CCCCC1
InChIInChI=1S/C15H18ClNO/c1-15(8-3-2-4-9-15)12-10-6-5-7-11(16)13(10)17-14(12)18/h5-7,12H,2-4,8-9H2,1H3,(H,17,18)
InChIKeyNATCTSHECJJUDC-UHFFFAOYSA-N
MW263.77 g/mol
LogP4.35
Rot. Bonds1

About 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one

7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one (PubChem CID 106986742) has the molecular formula C15H18ClNO and a molecular weight of 263.77 g/mol. Its IUPAC name is 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one
PubChem CID106986742
Molecular FormulaC15H18ClNO
Molecular Weight263.77 g/mol
Exact Mass263.11
IUPAC Name7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one
SMILESCC1(C2C(=O)Nc3c(Cl)cccc32)CCCCC1
InChIInChI=1S/C15H18ClNO/c1-15(8-3-2-4-9-15)12-10-6-5-7-11(16)13(10)17-14(12)18/h5-7,12H,2-4,8-9H2,1H3,(H,17,18)
InChIKeyNATCTSHECJJUDC-UHFFFAOYSA-N
XLogP4.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.77
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 7-chloro-3-(1-methylcyclohexyl)-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

7-chloro-3-(1-methylcyclohexyl)-2,3-dihydro-1H-indole
CID 106985936
7-chloro-3-(propan-2-ylamino)-1,3-dihydroindol-2-one
CID 82235334
7-chloro-3-(cyclopropylamino)-1,3-dihydroindol-2-one
CID 82239753
3-(2-aminoethyl)-7-chloro-1,3-dihydroindol-2-one
CID 63555300
3-(1-adamantyl)-7-methyl-1,3-dihydroindol-2-one
CID 106986659
8-chlorospiro[1,4-dihydroquinoxaline-3,1'-cycloheptane]-2-one
CID 104839626
3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one
CID 82081633
4-(2-chlorophenyl)-2-oxopyrrolidine-3-carboxylic acid
CID 82621815
6-chloro-3a-methyl-1,2,3,5,10,10a-hexahydrocyclopenta[b][1,5]benzodiazepin-4-one
CID 104839676
6-chloro-3a-methyl-2,3,4,9b-tetrahydro-1H-benzo[e]isoindol-5-one
CID 70664482
3-(2-chlorophenyl)-4-methyl-4-propylpiperidine-2,6-dione
CID 79454345
6-chlorospiro[2,5-dihydro-1,5-benzoxazepine-3,1'-cyclohexane]-4-one
CID 115099747

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one?
The IUPAC name of 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one (CID 106986742) is 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one is CC1(C2C(=O)Nc3c(Cl)cccc32)CCCCC1.
What is the InChIKey of 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one?
The InChIKey is NATCTSHECJJUDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClNO/c1-15(8-3-2-4-9-15)12-10-6-5-7-11(16)13(10)17-14(12)18/h5-7,12H,2-4,8-9H2,1H3,(H,17,18).
What are the key properties of 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one?
7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one has a molecular weight of 263.77 g/mol, XLogP of 4.35, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-(1-methylcyclohexyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 106986742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).