2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone

C16H22N2O — CID 82257913

IUPAC2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone
SMILESO=C(CNC1CCCCC1)c1ccc2c(c1)CCN2
InChIInChI=1S/C16H22N2O/c19-16(11-18-14-4-2-1-3-5-14)13-6-7-15-12(10-13)8-9-17-15/h6-7,10,14,17-18H,1-5,8-9,11H2
InChIKeyGBMSPXGNRNEYNZ-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.76
Rot. Bonds4

About 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone

2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone (PubChem CID 82257913) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone.

Molecular Properties

Compound Name2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone
PubChem CID82257913
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone
SMILESO=C(CNC1CCCCC1)c1ccc2c(c1)CCN2
InChIInChI=1S/C16H22N2O/c19-16(11-18-14-4-2-1-3-5-14)13-6-7-15-12(10-13)8-9-17-15/h6-7,10,14,17-18H,1-5,8-9,11H2
InChIKeyGBMSPXGNRNEYNZ-UHFFFAOYSA-N
XLogP2.76
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone 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-(cyclooctylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 82101392
cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone
CID 39243587
1-(4-aminophenyl)-2-(cyclohexylamino)ethanone
CID 82258202
N-cyclopropyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142413
N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 81385612
2-chloro-1-(2,3-dihydro-1H-indol-5-yl)ethanone;hydrochloride
CID 56766314
1-(4-aminophenyl)-2-(cyclopentylamino)ethanone
CID 82258201
2-(propan-2-ylamino)-1-(1,2,3,4-tetrahydroquinolin-6-yl)ethanone
CID 82257733
1-(2,3-dihydro-1H-indol-5-yl)-2-(2-methoxyethylamino)ethanone
CID 82102369
1-(2,3-dihydro-1H-indol-5-yl)-2-(pentylamino)ethanone
CID 82102357
3-[[2-(2,3-dihydro-1H-indol-5-yl)-2-oxoethyl]-methylamino]propanoic acid
CID 82102384
N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 107221941

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone?
The IUPAC name of 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone (CID 82257913) is 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone.
What is the SMILES notation for 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone?
The canonical SMILES for 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone is O=C(CNC1CCCCC1)c1ccc2c(c1)CCN2.
What is the InChIKey of 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone?
The InChIKey is GBMSPXGNRNEYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c19-16(11-18-14-4-2-1-3-5-14)13-6-7-15-12(10-13)8-9-17-15/h6-7,10,14,17-18H,1-5,8-9,11H2.
What are the key properties of 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone?
2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone has a molecular weight of 258.36 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone is sourced from PubChem (CID 82257913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).