2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine

C15H22N2O2S — CID 105361384

IUPAC2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine
SMILESNCCC1CN(S(=O)(=O)C2CCCC2)c2ccccc21
InChIInChI=1S/C15H22N2O2S/c16-10-9-12-11-17(15-8-4-3-7-14(12)15)20(18,19)13-5-1-2-6-13/h3-4,7-8,12-13H,1-2,5-6,9-11,16H2
InChIKeyCNZYLSYOQPKXCQ-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.21
Rot. Bonds4

About 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine

2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine (PubChem CID 105361384) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine
PubChem CID105361384
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC Name2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine
SMILESNCCC1CN(S(=O)(=O)C2CCCC2)c2ccccc21
InChIInChI=1S/C15H22N2O2S/c16-10-9-12-11-17(15-8-4-3-7-14(12)15)20(18,19)13-5-1-2-6-13/h3-4,7-8,12-13H,1-2,5-6,9-11,16H2
InChIKeyCNZYLSYOQPKXCQ-UHFFFAOYSA-N
XLogP2.21
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine 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

2-(1-methylsulfonyl-2,3-dihydroindol-3-yl)ethanamine
CID 63235698
2-[3-(2-aminoethyl)-2,3-dihydroindol-1-yl]acetic acid
CID 63235664
2-[1-(2-methylprop-2-enyl)-2,3-dihydroindol-3-yl]ethanamine
CID 63235614
3-(1-cyclohexyl-2,3-dihydroindol-3-yl)propan-1-amine
CID 117118566
1-[3-(2-aminoethyl)-2,3-dihydroindol-1-yl]propan-1-one
CID 63235471
[3-(2-aminoethyl)-2,3-dihydroindol-1-yl]-cyclohex-3-en-1-ylmethanone
CID 63235557
2-[1-[(4-iodophenyl)methyl]-2,3-dihydroindol-3-yl]ethanamine
CID 65477648
[3-(2-aminoethyl)-2,3-dihydroindol-1-yl]-(oxan-4-yl)methanone
CID 63234920
1-[3-(2-aminoethyl)-2,3-dihydroindol-1-yl]butan-1-one
CID 63235305
2-[1-(2-methylidenebutyl)-2,3-dihydroindol-3-yl]ethanamine
CID 66043826
2-[1-(4-propan-2-ylcyclohexyl)-2,3-dihydroindol-3-yl]ethanamine
CID 63553148
propan-2-yl 2-[3-(2-aminoethyl)-2,3-dihydroindol-1-yl]acetate
CID 63235879

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine?
The IUPAC name of 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine (CID 105361384) is 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine.
What is the SMILES notation for 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine?
The canonical SMILES for 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine is NCCC1CN(S(=O)(=O)C2CCCC2)c2ccccc21.
What is the InChIKey of 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine?
The InChIKey is CNZYLSYOQPKXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c16-10-9-12-11-17(15-8-4-3-7-14(12)15)20(18,19)13-5-1-2-6-13/h3-4,7-8,12-13H,1-2,5-6,9-11,16H2.
What are the key properties of 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine?
2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine has a molecular weight of 294.42 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylsulfonyl-2,3-dihydroindol-3-yl)ethanamine is sourced from PubChem (CID 105361384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).