1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone

C17H22N2O — CID 110702430

IUPAC1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone
SMILESCC1CCCC(C)N1C(=O)Cn1ccc2ccccc21
InChIInChI=1S/C17H22N2O/c1-13-6-5-7-14(2)19(13)17(20)12-18-11-10-15-8-3-4-9-16(15)18/h3-4,8-11,13-14H,5-7,12H2,1-2H3
InChIKeyYOGKRECYRUCMFO-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.43
Rot. Bonds2

About 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone

1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone (PubChem CID 110702430) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone.

Molecular Properties

Compound Name1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone
PubChem CID110702430
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone
SMILESCC1CCCC(C)N1C(=O)Cn1ccc2ccccc21
InChIInChI=1S/C17H22N2O/c1-13-6-5-7-14(2)19(13)17(20)12-18-11-10-15-8-3-4-9-16(15)18/h3-4,8-11,13-14H,5-7,12H2,1-2H3
InChIKeyYOGKRECYRUCMFO-UHFFFAOYSA-N
XLogP3.43
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone 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-indol-1-yl-1-(3-methylpiperidin-1-yl)ethanone
CID 110702436
2-[4-(2-indol-1-ylacetyl)piperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone
CID 87040579
2-indol-1-yl-1-pyrrolidin-1-ylethanone
CID 5191246
1-cyclopentyl-2-indol-1-ylethanone
CID 104751207
1-[4-[(1R,2S)-2-hydroxycyclopentyl]piperazin-1-yl]-2-indol-1-ylethanone
CID 95759248
1-(4-acetyl-1,4-diazepan-1-yl)-2-indol-1-ylethanone
CID 56817791
1-(2,6-dimethylpiperidin-1-yl)-2-(2-methylbenzimidazol-1-yl)ethanone
CID 73140279
2-[3-(cyclopropanecarbonyl)indol-1-yl]-1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]ethanone
CID 963220
1-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]indole-3-carbonitrile
CID 3145522
2-indol-1-yl-1-[4-[(3S)-3-methylpiperidine-1-carbonyl]piperidin-1-yl]ethanone
CID 52516114
1-[1-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]indol-3-yl]butan-1-one
CID 124549553
2-indol-1-yl-1-[(3S)-3-methoxypyrrolidin-1-yl]ethanone
CID 124848062

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone?
The IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone (CID 110702430) is 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone.
What is the SMILES notation for 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone?
The canonical SMILES for 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone is CC1CCCC(C)N1C(=O)Cn1ccc2ccccc21.
What is the InChIKey of 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone?
The InChIKey is YOGKRECYRUCMFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-13-6-5-7-14(2)19(13)17(20)12-18-11-10-15-8-3-4-9-16(15)18/h3-4,8-11,13-14H,5-7,12H2,1-2H3.
What are the key properties of 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone?
1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone has a molecular weight of 270.38 g/mol, XLogP of 3.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone is sourced from PubChem (CID 110702430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).