(3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide

C17H23N3O — CID 81133523

IUPAC(3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide
SMILESO=C(NCCCn1ccc2ccccc21)[C@@H]1CCCNC1
InChIInChI=1S/C17H23N3O/c21-17(15-6-3-9-18-13-15)19-10-4-11-20-12-8-14-5-1-2-7-16(14)20/h1-2,5,7-8,12,15,18H,3-4,6,9-11,13H2,(H,19,21)/t15-/m1/s1
InChIKeyTZXCJOHEULLOTK-OAHLLOKOSA-N
MW285.39 g/mol
LogP2.15
Rot. Bonds5

About (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide

(3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide (PubChem CID 81133523) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide
PubChem CID81133523
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name(3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide
SMILESO=C(NCCCn1ccc2ccccc21)[C@@H]1CCCNC1
InChIInChI=1S/C17H23N3O/c21-17(15-6-3-9-18-13-15)19-10-4-11-20-12-8-14-5-1-2-7-16(14)20/h1-2,5,7-8,12,15,18H,3-4,6,9-11,13H2,(H,19,21)/t15-/m1/s1
InChIKeyTZXCJOHEULLOTK-OAHLLOKOSA-N
XLogP2.15
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.15
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

(3R)-N-[3-(2,3-dihydroindol-1-yl)propyl]piperidine-3-carboxamide
CID 81133525
(3R)-N-(3-piperidin-1-ylpropyl)piperidine-3-carboxamide
CID 81123639
1-(3-indol-1-ylpropyl)-3-(3-piperidin-1-ylpropyl)urea
CID 112806234
N-[3-(azepan-1-yl)propyl]piperidine-3-carboxamide;dihydrochloride
CID 119831193
N-[2-(4-fluoro-1-methylbenzimidazol-2-yl)ethyl]piperidine-3-carboxamide
CID 119883596
1-hydroxy-N-(3-indol-1-ylpropyl)cyclopentane-1-carboxamide
CID 110907067
N-[3-(4-methoxyphenyl)propyl]piperidine-3-carboxamide
CID 119299643
N-(3-indol-1-ylpropyl)-5-oxo-1,4-thiazepane-3-carboxamide
CID 102553021
1-(4-acetylphenyl)sulfonyl-N-(3-indol-1-ylpropyl)piperidine-4-carboxamide
CID 55349126
N-(3-indol-1-ylpropyl)-6-oxo-1-(2-phenylethyl)piperidine-3-carboxamide
CID 56701349
N-[3-(3-oxo-1,4-benzoxazin-4-yl)propyl]piperidine-3-carboxamide;hydrochloride
CID 119333239
2,2-difluoro-N-(3-indol-1-ylpropyl)acetamide
CID 113218212

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide (CID 81133523) is (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide is O=C(NCCCn1ccc2ccccc21)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide?
The InChIKey is TZXCJOHEULLOTK-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H23N3O/c21-17(15-6-3-9-18-13-15)19-10-4-11-20-12-8-14-5-1-2-7-16(14)20/h1-2,5,7-8,12,15,18H,3-4,6,9-11,13H2,(H,19,21)/t15-/m1/s1.
What are the key properties of (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide?
(3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide has a molecular weight of 285.39 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(3-indol-1-ylpropyl)piperidine-3-carboxamide is sourced from PubChem (CID 81133523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).