6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one

C21H22N2O2 — CID 15425455

IUPAC6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one
SMILESO=C1CCCC(O)N1CCc1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C21H22N2O2/c24-19-11-6-12-20(25)23(19)14-13-17-16-9-4-5-10-18(16)22-21(17)15-7-2-1-3-8-15/h1-5,7-10,19,22,24H,6,11-14H2
InChIKeyQFEXIGPEWFJUPB-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.71
Rot. Bonds4

About 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one

6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one (PubChem CID 15425455) has the molecular formula C21H22N2O2 and a molecular weight of 334.42 g/mol. Its IUPAC name is 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one.

Molecular Properties

Compound Name6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one
PubChem CID15425455
Molecular FormulaC21H22N2O2
Molecular Weight334.42 g/mol
Exact Mass334.17
IUPAC Name6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one
SMILESO=C1CCCC(O)N1CCc1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C21H22N2O2/c24-19-11-6-12-20(25)23(19)14-13-17-16-9-4-5-10-18(16)22-21(17)15-7-2-1-3-8-15/h1-5,7-10,19,22,24H,6,11-14H2
InChIKeyQFEXIGPEWFJUPB-UHFFFAOYSA-N
XLogP3.71
TPSA56.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-phenyl-1H-indole
CID 59920990
3-[2-(2-methylpiperidin-1-yl)ethyl]-2-phenyl-1H-indole
CID 3054786
2-(2-phenyl-1H-indol-3-yl)ethylazanium chloride
CID 69323264
3-[(1-methylpyrrolidin-3-yl)methyl]-2-phenyl-1H-indole;oxalic acid
CID 18403268
1-(2-phenyl-1H-indol-3-yl)propan-2-one
CID 83780172
3-[(2-methyl-2-azabicyclo[2.2.2]octan-3-yl)methyl]-2-phenyl-1H-indole;oxalic acid
CID 18403269
2-[2-[3-(2-hydroxyethyl)-1H-indol-2-yl]-1H-indol-3-yl]ethanol
CID 86024266
2-[4-[(2-phenyl-1H-indol-3-yl)methyl]phenyl]cyclohexane-1-carboxylic acid
CID 15342294
3-(2-hydroxy-5-oxopyrrolidin-1-yl)-N-(4-phenylphenyl)propanamide
CID 176994034
2-(3-fluorophenyl)-3-(2-pyrrolidin-1-ylethyl)-1H-indole
CID 59920997
2-[4-[2-[2-(4-fluorophenyl)-1H-indol-3-yl]ethyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 59920987
2-(3-fluorophenyl)-3-[2-(2-methylpyrrolidin-1-yl)ethyl]-1H-indole
CID 59921018

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one?
The IUPAC name of 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one (CID 15425455) is 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one.
What is the SMILES notation for 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one?
The canonical SMILES for 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one is O=C1CCCC(O)N1CCc1c(-c2ccccc2)[nH]c2ccccc12.
What is the InChIKey of 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one?
The InChIKey is QFEXIGPEWFJUPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O2/c24-19-11-6-12-20(25)23(19)14-13-17-16-9-4-5-10-18(16)22-21(17)15-7-2-1-3-8-15/h1-5,7-10,19,22,24H,6,11-14H2.
What are the key properties of 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one?
6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one has a molecular weight of 334.42 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-1-[2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-2-one is sourced from PubChem (CID 15425455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).