N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide

C13H23N3O — CID 43696376

IUPACN-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide
SMILESO=C(NC1CCN2CCCC12)C1CCCNC1
InChIInChI=1S/C13H23N3O/c17-13(10-3-1-6-14-9-10)15-11-5-8-16-7-2-4-12(11)16/h10-12,14H,1-9H2,(H,15,17)
InChIKeyDWKDOAGTPSVQRD-UHFFFAOYSA-N
MW237.35 g/mol
LogP0.34
Rot. Bonds2

About N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide

N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide (PubChem CID 43696376) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide
PubChem CID43696376
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC NameN-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide
SMILESO=C(NC1CCN2CCCC12)C1CCCNC1
InChIInChI=1S/C13H23N3O/c17-13(10-3-1-6-14-9-10)15-11-5-8-16-7-2-4-12(11)16/h10-12,14H,1-9H2,(H,15,17)
InChIKeyDWKDOAGTPSVQRD-UHFFFAOYSA-N
XLogP0.34
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide 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

N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-2-carboxamide
CID 43696375
3-(aminomethyl)-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)cyclohexane-1-carboxamide
CID 62807129
N-[(1R,2R)-2-hydroxycyclohexyl]piperidine-3-carboxamide
CID 107222065
N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-2-methylpyrrolidine-3-carboxamide
CID 79388899
N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)pyrrolidine-1-carboxamide
CID 115584130
N-(2-imidazol-1-ylcyclopentyl)piperidine-3-carboxamide
CID 43713483
(3S)-N-cyclobutylpiperidine-3-carboxamide
CID 81141296
cis-(1S,2R)-N-[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-2-methylcyclopropane-1-carboxamide
CID 94121437
(3R)-N-(2-methylcycloheptyl)piperidine-3-carboxamide
CID 81134931
N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)acetamide
CID 60770068
N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide
CID 103796632
(2S)-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61178008

Frequently Asked Questions

What is the IUPAC name of N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide?
The IUPAC name of N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide (CID 43696376) is N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide?
The canonical SMILES for N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide is O=C(NC1CCN2CCCC12)C1CCCNC1.
What is the InChIKey of N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide?
The InChIKey is DWKDOAGTPSVQRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c17-13(10-3-1-6-14-9-10)15-11-5-8-16-7-2-4-12(11)16/h10-12,14H,1-9H2,(H,15,17).
What are the key properties of N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide?
N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide has a molecular weight of 237.35 g/mol, XLogP of 0.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)piperidine-3-carboxamide is sourced from PubChem (CID 43696376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).