N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide

C13H25N3O2 — CID 79161943

IUPACN-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide
SMILESO=C(NCCCOC1CCNCC1)N1CCCC1
InChIInChI=1S/C13H25N3O2/c17-13(16-9-1-2-10-16)15-6-3-11-18-12-4-7-14-8-5-12/h12,14H,1-11H2,(H,15,17)
InChIKeyCXCGUMVYHNIRAZ-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.95
Rot. Bonds5

About N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide

N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide (PubChem CID 79161943) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide
PubChem CID79161943
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide
SMILESO=C(NCCCOC1CCNCC1)N1CCCC1
InChIInChI=1S/C13H25N3O2/c17-13(16-9-1-2-10-16)15-6-3-11-18-12-4-7-14-8-5-12/h12,14H,1-11H2,(H,15,17)
InChIKeyCXCGUMVYHNIRAZ-UHFFFAOYSA-N
XLogP0.95
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide (CID 79161943) is N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide is O=C(NCCCOC1CCNCC1)N1CCCC1.
What is the InChIKey of N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide?
The InChIKey is CXCGUMVYHNIRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c17-13(16-9-1-2-10-16)15-6-3-11-18-12-4-7-14-8-5-12/h12,14H,1-11H2,(H,15,17).
What are the key properties of N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide?
N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-piperidin-4-yloxypropyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 79161943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).