1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one

C19H23N3O2 — CID 126855901

IUPAC1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one
SMILESO=C(Cc1c[nH]c2ccccc12)N1CCC(N2CCCC2=O)CC1
InChIInChI=1S/C19H23N3O2/c23-18-6-3-9-22(18)15-7-10-21(11-8-15)19(24)12-14-13-20-17-5-2-1-4-16(14)17/h1-2,4-5,13,15,20H,3,6-12H2
InChIKeyKCQYRNZSJSBIGM-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.32
Rot. Bonds3

About 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one

1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one (PubChem CID 126855901) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one
PubChem CID126855901
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one
SMILESO=C(Cc1c[nH]c2ccccc12)N1CCC(N2CCCC2=O)CC1
InChIInChI=1S/C19H23N3O2/c23-18-6-3-9-22(18)15-7-10-21(11-8-15)19(24)12-14-13-20-17-5-2-1-4-16(14)17/h1-2,4-5,13,15,20H,3,6-12H2
InChIKeyKCQYRNZSJSBIGM-UHFFFAOYSA-N
XLogP2.32
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-(1H-indole-3-carbonyl)piperidin-4-yl]pyrrolidin-2-one
CID 126855908
1-cyclopropyl-4-[2-(1H-indol-3-yl)acetyl]piperazin-2-one
CID 110743361
1-[1-[2-(1H-indol-3-yl)ethyl]piperidin-4-yl]pyrrolidin-2-one
CID 56872329
1-[2-(1H-indol-3-yl)acetyl]piperidin-4-one
CID 28753763
1-[(4S)-4-aminoazepan-1-yl]-2-(1H-indol-3-yl)ethanone
CID 95726890
1-(4-aminoazepan-1-yl)-2-(1H-indol-3-yl)ethanone
CID 56912314
2-(1H-indol-3-yl)-1-(4-methylazepan-1-yl)ethanone
CID 62047169
1-[4-(aminomethyl)piperidin-1-yl]-2-(1H-indol-3-yl)ethanone
CID 28706781
1-[4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)piperidin-1-yl]-2-(1H-indol-3-yl)ethanone
CID 75479286
1-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-2-(1H-indol-3-yl)ethanone
CID 110806405
(1R,2R,9R)-11-[1-[3-(1H-indol-3-yl)propanoyl]piperidin-4-yl]-7,11-diazatricyclo[7.3.1.02,7]tridecan-6-one
CID 110195187
1-[4-[2-(1H-indol-3-yl)acetyl]piperazin-1-yl]-2-methylpropan-1-one
CID 18159897

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one?
The IUPAC name of 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one (CID 126855901) is 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one.
What is the SMILES notation for 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one?
The canonical SMILES for 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one is O=C(Cc1c[nH]c2ccccc12)N1CCC(N2CCCC2=O)CC1.
What is the InChIKey of 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one?
The InChIKey is KCQYRNZSJSBIGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c23-18-6-3-9-22(18)15-7-10-21(11-8-15)19(24)12-14-13-20-17-5-2-1-4-16(14)17/h1-2,4-5,13,15,20H,3,6-12H2.
What are the key properties of 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one?
1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one has a molecular weight of 325.41 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one is sourced from PubChem (CID 126855901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).