4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine

C14H24N4O — CID 63876860

IUPAC4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine
SMILESC1CCC(c2n[nH]c(CCOC3CCNCC3)n2)C1
InChIInChI=1S/C14H24N4O/c1-2-4-11(3-1)14-16-13(17-18-14)7-10-19-12-5-8-15-9-6-12/h11-12,15H,1-10H2,(H,16,17,18)
InChIKeyZEGJYTPZLLIFJI-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.77
Rot. Bonds5

About 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine

4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine (PubChem CID 63876860) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine.

Molecular Properties

Compound Name4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine
PubChem CID63876860
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine
SMILESC1CCC(c2n[nH]c(CCOC3CCNCC3)n2)C1
InChIInChI=1S/C14H24N4O/c1-2-4-11(3-1)14-16-13(17-18-14)7-10-19-12-5-8-15-9-6-12/h11-12,15H,1-10H2,(H,16,17,18)
InChIKeyZEGJYTPZLLIFJI-UHFFFAOYSA-N
XLogP1.77
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine 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 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine?
The IUPAC name of 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine (CID 63876860) is 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine.
What is the SMILES notation for 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine?
The canonical SMILES for 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine is C1CCC(c2n[nH]c(CCOC3CCNCC3)n2)C1.
What is the InChIKey of 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine?
The InChIKey is ZEGJYTPZLLIFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-2-4-11(3-1)14-16-13(17-18-14)7-10-19-12-5-8-15-9-6-12/h11-12,15H,1-10H2,(H,16,17,18).
What are the key properties of 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine?
4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine has a molecular weight of 264.37 g/mol, XLogP of 1.77, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3-cyclopentyl-1H-1,2,4-triazol-5-yl)ethoxy]piperidine is sourced from PubChem (CID 63876860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).