1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one

C15H18N2O — CID 14090373

IUPAC1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one
SMILESO=C1CCCCN1CCc1cc2ccccc2[nH]1
InChIInChI=1S/C15H18N2O/c18-15-7-3-4-9-17(15)10-8-13-11-12-5-1-2-6-14(12)16-13/h1-2,5-6,11,16H,3-4,7-10H2
InChIKeyHDLIIIDZRJLPDI-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.72
Rot. Bonds3

About 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one

1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one (PubChem CID 14090373) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one.

Molecular Properties

Compound Name1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one
PubChem CID14090373
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one
SMILESO=C1CCCCN1CCc1cc2ccccc2[nH]1
InChIInChI=1S/C15H18N2O/c18-15-7-3-4-9-17(15)10-8-13-11-12-5-1-2-6-14(12)16-13/h1-2,5-6,11,16H,3-4,7-10H2
InChIKeyHDLIIIDZRJLPDI-UHFFFAOYSA-N
XLogP2.72
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-amino-1-[2-(1H-indol-2-yl)ethyl]pyrrolidin-2-one
CID 168700196
4-(aminomethyl)-1-[2-(1H-indol-2-yl)ethyl]pyrrolidin-2-one
CID 168660253
methyl 1-[2-(1H-indol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxylate
CID 168694187
4-(azidomethyl)-1-[2-(1H-indol-2-yl)ethyl]pyrrolidin-2-one
CID 168657252
3-[[2-[2-(2-oxopyrrolidin-1-yl)ethyl]piperidin-1-yl]methyl]-1H-quinolin-2-one
CID 56718060
2-(2-fluoroethyl)-1H-indole
CID 142633825
3-(1H-indol-2-ylmethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 75447180
2-(1H-indol-2-yl)ethanamine;hydroiodide
CID 175201769
2-[4-(1H-indol-2-yl)butyl]-3-(2-pyrrolidin-1-ylethyl)-1H-indole
CID 67798369
3-(1H-indol-2-yl)-1-phenyl-2-piperidin-1-ylpropan-1-one
CID 70630041
2-(3-chloropropyl)-1H-indole
CID 13271043
1-[2-[2-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-(1H-indol-2-yl)butyl]-1H-indol-3-yl]ethyl]-3,4-dihydro-2H-quinoline
CID 67752210

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one?
The IUPAC name of 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one (CID 14090373) is 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one.
What is the SMILES notation for 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one?
The canonical SMILES for 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one is O=C1CCCCN1CCc1cc2ccccc2[nH]1.
What is the InChIKey of 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one?
The InChIKey is HDLIIIDZRJLPDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c18-15-7-3-4-9-17(15)10-8-13-11-12-5-1-2-6-14(12)16-13/h1-2,5-6,11,16H,3-4,7-10H2.
What are the key properties of 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one?
1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one has a molecular weight of 242.32 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1H-indol-2-yl)ethyl]piperidin-2-one is sourced from PubChem (CID 14090373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).