1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone

C16H20N2O2 — CID 53014569

IUPAC1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
SMILESCC(=O)N1CCc2c(C(=O)N3CCCCC3)cccc21
InChIInChI=1S/C16H20N2O2/c1-12(19)18-11-8-13-14(6-5-7-15(13)18)16(20)17-9-3-2-4-10-17/h5-7H,2-4,8-11H2,1H3
InChIKeyFHAIIZPRXCANRI-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.22
Rot. Bonds1

About 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone

1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone (PubChem CID 53014569) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
PubChem CID53014569
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
SMILESCC(=O)N1CCc2c(C(=O)N3CCCCC3)cccc21
InChIInChI=1S/C16H20N2O2/c1-12(19)18-11-8-13-14(6-5-7-15(13)18)16(20)17-9-3-2-4-10-17/h5-7H,2-4,8-11H2,1H3
InChIKeyFHAIIZPRXCANRI-UHFFFAOYSA-N
XLogP2.22
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone 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

1-(4-hydroxy-2,3-dihydroindol-1-yl)ethanone
CID 19598465
1-(4-amino-2,3-dihydroindol-1-yl)ethanone
CID 13236630
1-[4-[2-chloro-3-(pyrrolidine-1-carbonyl)phenyl]piperazin-1-yl]ethanone
CID 145286557
[2-(piperidine-1-carbonyl)phenyl]boronic acid
CID 90477220
[1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindol-4-yl]-pyrrolidin-1-ylmethanone
CID 53160216
(4-amino-2,3-dihydroindol-1-yl)-(azepan-1-yl)methanone
CID 79152622
azepan-1-yl(1,2,3,4-tetrahydroisoquinolin-5-yl)methanone
CID 104557845
2-(piperidine-1-carbonyl)phenolate
CID 101121314
azepan-1-yl-(2-methylphenyl)methanone
CID 4616576
1-[4-(1-aminocyclopentyl)-2,3-dihydroindol-1-yl]ethanone
CID 117362996
2-iodo-3-(pyrrolidine-1-carbonyl)benzoic acid
CID 169449836
azepan-1-yl-(2-bromo-3-methylphenyl)methanone
CID 103852629

Frequently Asked Questions

What is the IUPAC name of 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone?
The IUPAC name of 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone (CID 53014569) is 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone.
What is the SMILES notation for 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone?
The canonical SMILES for 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone is CC(=O)N1CCc2c(C(=O)N3CCCCC3)cccc21.
What is the InChIKey of 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone?
The InChIKey is FHAIIZPRXCANRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12(19)18-11-8-13-14(6-5-7-15(13)18)16(20)17-9-3-2-4-10-17/h5-7H,2-4,8-11H2,1H3.
What are the key properties of 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone?
1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone has a molecular weight of 272.35 g/mol, XLogP of 2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(piperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone is sourced from PubChem (CID 53014569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).