3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine

C14H19N5 — CID 176815874

IUPAC3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine
SMILESCCn1cc(-c2cncc(N3CCCCC3)c2)nn1
InChIInChI=1S/C14H19N5/c1-2-19-11-14(16-17-19)12-8-13(10-15-9-12)18-6-4-3-5-7-18/h8-11H,2-7H2,1H3
InChIKeyLLTUTCFRDHVYRS-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.35
Rot. Bonds3

About 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine

3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine (PubChem CID 176815874) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine.

Molecular Properties

Compound Name3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine
PubChem CID176815874
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine
SMILESCCn1cc(-c2cncc(N3CCCCC3)c2)nn1
InChIInChI=1S/C14H19N5/c1-2-19-11-14(16-17-19)12-8-13(10-15-9-12)18-6-4-3-5-7-18/h8-11H,2-7H2,1H3
InChIKeyLLTUTCFRDHVYRS-UHFFFAOYSA-N
XLogP2.35
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine?
The IUPAC name of 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine (CID 176815874) is 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine.
What is the SMILES notation for 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine?
The canonical SMILES for 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine is CCn1cc(-c2cncc(N3CCCCC3)c2)nn1.
What is the InChIKey of 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine?
The InChIKey is LLTUTCFRDHVYRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-2-19-11-14(16-17-19)12-8-13(10-15-9-12)18-6-4-3-5-7-18/h8-11H,2-7H2,1H3.
What are the key properties of 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine?
3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine has a molecular weight of 257.34 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethyltriazol-4-yl)-5-piperidin-1-ylpyridine is sourced from PubChem (CID 176815874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).