2-(3-ethyltriazol-4-yl)-4-methylpiperidine

C10H18N4 — CID 130484363

IUPAC2-(3-ethyltriazol-4-yl)-4-methylpiperidine
SMILESCCn1nncc1C1CC(C)CCN1
InChIInChI=1S/C10H18N4/c1-3-14-10(7-12-13-14)9-6-8(2)4-5-11-9/h7-9,11H,3-6H2,1-2H3
InChIKeyNHDGZRSQCHWZPL-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.36
Rot. Bonds2

About 2-(3-ethyltriazol-4-yl)-4-methylpiperidine

2-(3-ethyltriazol-4-yl)-4-methylpiperidine (PubChem CID 130484363) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-(3-ethyltriazol-4-yl)-4-methylpiperidine.

Molecular Properties

Compound Name2-(3-ethyltriazol-4-yl)-4-methylpiperidine
PubChem CID130484363
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name2-(3-ethyltriazol-4-yl)-4-methylpiperidine
SMILESCCn1nncc1C1CC(C)CCN1
InChIInChI=1S/C10H18N4/c1-3-14-10(7-12-13-14)9-6-8(2)4-5-11-9/h7-9,11H,3-6H2,1-2H3
InChIKeyNHDGZRSQCHWZPL-UHFFFAOYSA-N
XLogP1.36
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyltriazol-4-yl)-4-methylpiperidine?
The IUPAC name of 2-(3-ethyltriazol-4-yl)-4-methylpiperidine (CID 130484363) is 2-(3-ethyltriazol-4-yl)-4-methylpiperidine.
What is the SMILES notation for 2-(3-ethyltriazol-4-yl)-4-methylpiperidine?
The canonical SMILES for 2-(3-ethyltriazol-4-yl)-4-methylpiperidine is CCn1nncc1C1CC(C)CCN1.
What is the InChIKey of 2-(3-ethyltriazol-4-yl)-4-methylpiperidine?
The InChIKey is NHDGZRSQCHWZPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-3-14-10(7-12-13-14)9-6-8(2)4-5-11-9/h7-9,11H,3-6H2,1-2H3.
What are the key properties of 2-(3-ethyltriazol-4-yl)-4-methylpiperidine?
2-(3-ethyltriazol-4-yl)-4-methylpiperidine has a molecular weight of 194.28 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyltriazol-4-yl)-4-methylpiperidine is sourced from PubChem (CID 130484363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).