1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide

C17H22N2O2 — CID 110907067

IUPAC1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide
SMILESO=C(NCCCn1ccc2ccccc21)C1(O)CCCC1
InChIInChI=1S/C17H22N2O2/c20-16(17(21)9-3-4-10-17)18-11-5-12-19-13-8-14-6-1-2-7-15(14)19/h1-2,6-8,13,21H,3-5,9-12H2,(H,18,20)
InChIKeyFXOIMOSABIIYOM-UHFFFAOYSA-N
MW286.37 g/mol
LogP2.45
Rot. Bonds5

About 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide

1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide (PubChem CID 110907067) has the molecular formula C17H22N2O2 and a molecular weight of 286.37 g/mol. Its IUPAC name is 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide
PubChem CID110907067
Molecular FormulaC17H22N2O2
Molecular Weight286.37 g/mol
Exact Mass286.17
IUPAC Name1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide
SMILESO=C(NCCCn1ccc2ccccc21)C1(O)CCCC1
InChIInChI=1S/C17H22N2O2/c20-16(17(21)9-3-4-10-17)18-11-5-12-19-13-8-14-6-1-2-7-15(14)19/h1-2,6-8,13,21H,3-5,9-12H2,(H,18,20)
InChIKeyFXOIMOSABIIYOM-UHFFFAOYSA-N
XLogP2.45
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(3-indol-1-ylpropyl)-3-(3-piperidin-1-ylpropyl)urea
CID 112806234
2,2-difluoro-N-(3-indol-1-ylpropyl)acetamide
CID 113218212
4-(hydroxymethyl)-N-(3-indol-1-ylpropyl)-4-methylpiperidine-1-carboxamide
CID 136531373
1-[[2-(hydroxymethyl)phenyl]methyl]-3-(3-indol-1-ylpropyl)urea
CID 110911712
N-(2-indol-1-ylethyl)-4-phenyloxane-4-carboxamide
CID 56763634
N-(3-indol-1-ylpropyl)-2-methyl-2-(methylamino)propanamide
CID 62845640
N-(3-indol-1-ylpropyl)-1-methylpyrrole-2-carboxamide
CID 78799397
(2S)-N-(3-indol-1-ylpropyl)-2-methylsulfonylpropanamide
CID 94154350
(3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide
CID 81133523
1-[[4-(dimethylamino)phenyl]methyl]-3-(3-indol-1-ylpropyl)urea
CID 52546228
2,2,3,3-tetrafluoro-N-(3-indol-1-ylpropyl)propanamide
CID 103732076
N-(3-indol-1-ylpropyl)-N'-methylpyrrolidine-1-carboximidamide
CID 110933615

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide (CID 110907067) is 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide is O=C(NCCCn1ccc2ccccc21)C1(O)CCCC1.
What is the InChIKey of 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide?
The InChIKey is FXOIMOSABIIYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c20-16(17(21)9-3-4-10-17)18-11-5-12-19-13-8-14-6-1-2-7-15(14)19/h1-2,6-8,13,21H,3-5,9-12H2,(H,18,20).
What are the key properties of 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide?
1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide has a molecular weight of 286.37 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 110907067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).