4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine

C10H18N4O — CID 63875830

IUPAC4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine
SMILESCCn1cnnc1COC1CCNCC1
InChIInChI=1S/C10H18N4O/c1-2-14-8-12-13-10(14)7-15-9-3-5-11-6-4-9/h8-9,11H,2-7H2,1H3
InChIKeyKIMCCYZXXXJPQL-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.57
Rot. Bonds4

About 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine

4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine (PubChem CID 63875830) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine.

Molecular Properties

Compound Name4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine
PubChem CID63875830
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine
SMILESCCn1cnnc1COC1CCNCC1
InChIInChI=1S/C10H18N4O/c1-2-14-8-12-13-10(14)7-15-9-3-5-11-6-4-9/h8-9,11H,2-7H2,1H3
InChIKeyKIMCCYZXXXJPQL-UHFFFAOYSA-N
XLogP0.57
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(4-methyl-1,2,4-triazol-3-yl)ethoxy]piperidine
CID 63875829
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]piperidine-4-sulfonamide
CID 106303559
4-[2-(4-cyclopentyl-1,2,4-triazol-3-yl)ethoxy]piperidine
CID 55251532
4-[(3-propylimidazol-4-yl)methoxy]piperidine
CID 106937644
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-2-piperidin-4-ylethanesulfonamide
CID 106303221
3-(cycloheptylmethyl)-4-ethyl-1,2,4-triazole
CID 114459441
3-ethoxy-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]cyclobutan-1-amine
CID 103920990
3-(azetidin-3-yl)-4-ethyl-1,2,4-triazole
CID 79316888
4-fluoro-1-methyl-2-(piperidin-4-yloxymethyl)benzimidazole
CID 63870568
7-methyl-3-(piperidin-4-yloxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 81252552
4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine
CID 106939218
3-(4-ethyl-1,2,4-triazol-3-yl)piperidine;dihydrochloride
CID 50988337

Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine?
The IUPAC name of 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine (CID 63875830) is 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine.
What is the SMILES notation for 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine?
The canonical SMILES for 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine is CCn1cnnc1COC1CCNCC1.
What is the InChIKey of 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine?
The InChIKey is KIMCCYZXXXJPQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-2-14-8-12-13-10(14)7-15-9-3-5-11-6-4-9/h8-9,11H,2-7H2,1H3.
What are the key properties of 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine?
4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine has a molecular weight of 210.28 g/mol, XLogP of 0.57, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethyl-1,2,4-triazol-3-yl)methoxy]piperidine is sourced from PubChem (CID 63875830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).