2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol

C8H15N3O2 — CID 155740435

IUPAC2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol
SMILESCCn1cc(CCOCCO)nn1
InChIInChI=1S/C8H15N3O2/c1-2-11-7-8(9-10-11)3-5-13-6-4-12/h7,12H,2-6H2,1H3
InChIKeyMABUMHPSQKBTQC-UHFFFAOYSA-N
MW185.23 g/mol
LogP-0.15
Rot. Bonds6

About 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol

2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol (PubChem CID 155740435) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol
PubChem CID155740435
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol
SMILESCCn1cc(CCOCCO)nn1
InChIInChI=1S/C8H15N3O2/c1-2-11-7-8(9-10-11)3-5-13-6-4-12/h7,12H,2-6H2,1H3
InChIKeyMABUMHPSQKBTQC-UHFFFAOYSA-N
XLogP-0.15
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-4-(2-propoxyethyl)triazole
CID 162703060
N-[2-[2-(1-ethyltriazol-4-yl)ethoxy]ethoxymethyl]propan-1-amine
CID 159191792
1-ethyl-4-[3-(2-propan-2-yloxyethoxy)propyl]triazole
CID 155402046
2-[2-[4-(methylaminomethyl)triazol-1-yl]ethoxy]ethanol
CID 66215241
1-[1-[2-(2-hydroxyethoxy)ethyl]triazol-4-yl]-2-methylpropan-2-ol
CID 90985884
bis(1,4-diethyltriazole);ethane
CID 160569546
2-[2-[2-[2-[4-[[bis[[1-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]triazol-4-yl]methyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethanol
CID 102046479
4-[2-[2-[[2-(but-3-ynoxymethyl)-2-(methoxymethyl)butoxy]methyl]-2-ethylbutoxy]ethyl]-1-ethyltriazole
CID 118372634
3-[1-[3-(2-methoxyethoxy)propyl]triazol-4-yl]propan-1-ol
CID 103412240
4-(bromomethyl)-1-ethyltriazole
CID 62400485
2-[2-[2-[2-(4-hept-6-enyltriazol-1-yl)ethoxy]ethoxy]ethoxy]ethanol
CID 139212566
1-ethyl-4-(sulfanyloxymethyl)triazole
CID 177230256

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol?
The IUPAC name of 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol (CID 155740435) is 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol?
The canonical SMILES for 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol is CCn1cc(CCOCCO)nn1.
What is the InChIKey of 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol?
The InChIKey is MABUMHPSQKBTQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-2-11-7-8(9-10-11)3-5-13-6-4-12/h7,12H,2-6H2,1H3.
What are the key properties of 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol?
2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol has a molecular weight of 185.23 g/mol, XLogP of -0.15, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-ethyltriazol-4-yl)ethoxy]ethanol is sourced from PubChem (CID 155740435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).