2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone

C16H22N2O — CID 43142508

IUPAC2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone
SMILESCC1CCCC(C)N1C(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C16H22N2O/c1-11-4-3-5-12(2)18(11)16(19)14-6-7-15-13(10-14)8-9-17-15/h6-7,10-12,17H,3-5,8-9H2,1-2H3
InChIKeyFOLBNSSBNOHWCG-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.06
Rot. Bonds1

About 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone

2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone (PubChem CID 43142508) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone
PubChem CID43142508
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone
SMILESCC1CCCC(C)N1C(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C16H22N2O/c1-11-4-3-5-12(2)18(11)16(19)14-6-7-15-13(10-14)8-9-17-15/h6-7,10-12,17H,3-5,8-9H2,1-2H3
InChIKeyFOLBNSSBNOHWCG-UHFFFAOYSA-N
XLogP3.06
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-indol-5-yl)-2-(2,6-dimethylpiperidin-1-yl)propan-1-one
CID 82102465
[4-[(2S,6R)-2,6-dimethylpiperidine-1-carbonyl]phenyl]-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone
CID 129377323
2,3-dihydro-1H-indol-5-yl-(2-ethylpyrrolidin-1-yl)methanone
CID 54886081
2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone
CID 93394367
1-[4-(2,3-dihydro-1H-indole-5-carbonyl)piperazin-1-yl]ethanone
CID 60893291
1-(2,3-dihydro-1H-indol-5-yl)ethanone
CID 170999934
4-(2,3-dihydro-1H-indole-5-carbonyl)-3-methylpiperazin-2-one
CID 63606218
1-(2,3-dihydro-1H-indole-5-carbonyl)pyrrolidine-2-carboxylic acid
CID 61157126
cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone
CID 39243587
(4-aminophenyl)-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanone
CID 30115915
2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone
CID 63217542
5-(2,6-dimethylpiperidine-1-carbonyl)-3,3-dimethyl-1H-indol-2-one
CID 110700531

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone (CID 43142508) is 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone is CC1CCCC(C)N1C(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone?
The InChIKey is FOLBNSSBNOHWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-11-4-3-5-12(2)18(11)16(19)14-6-7-15-13(10-14)8-9-17-15/h6-7,10-12,17H,3-5,8-9H2,1-2H3.
What are the key properties of 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone?
2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone has a molecular weight of 258.36 g/mol, XLogP of 3.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone is sourced from PubChem (CID 43142508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).