1-(2-methyltriazol-4-yl)ethanol

C5H9N3O — CID 130521764

IUPAC1-(2-methyltriazol-4-yl)ethanol
SMILESCC(O)c1cnn(C)n1
InChIInChI=1S/C5H9N3O/c1-4(9)5-3-6-8(2)7-5/h3-4,9H,1-2H3
InChIKeyOBMUFLIZWCZXGS-UHFFFAOYSA-N
MW127.15 g/mol
LogP-0.13
Rot. Bonds1

About 1-(2-methyltriazol-4-yl)ethanol

1-(2-methyltriazol-4-yl)ethanol (PubChem CID 130521764) has the molecular formula C5H9N3O and a molecular weight of 127.15 g/mol. Its IUPAC name is 1-(2-methyltriazol-4-yl)ethanol.

Molecular Properties

Compound Name1-(2-methyltriazol-4-yl)ethanol
PubChem CID130521764
Molecular FormulaC5H9N3O
Molecular Weight127.15 g/mol
Exact Mass127.07
IUPAC Name1-(2-methyltriazol-4-yl)ethanol
SMILESCC(O)c1cnn(C)n1
InChIInChI=1S/C5H9N3O/c1-4(9)5-3-6-8(2)7-5/h3-4,9H,1-2H3
InChIKeyOBMUFLIZWCZXGS-UHFFFAOYSA-N
XLogP-0.13
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.15
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

cyclohexyl-(2-methyltriazol-4-yl)methanol
CID 130521712
3-methyl-4-(2-methyltriazol-4-yl)butan-2-ol
CID 130592094
2-amino-2-cyclopropyl-1-(2-methyltriazol-4-yl)propan-1-ol
CID 164650248
3-amino-3-(2-methyltriazol-4-yl)propanoic acid
CID 130613907
2-(methylamino)-2-(2-methyltriazol-4-yl)acetic acid;hydrochloride
CID 154852937
N,N-dimethyl-1-(2-methyltriazol-4-yl)ethane-1,2-diamine
CID 131029070
N-methyl-1-(2-methyltriazol-4-yl)prop-2-yn-1-amine
CID 130521607
N-[4-(1-hydroxyethyl)-1,3-thiazol-2-yl]-2-methyltriazole-4-carboxamide
CID 112735662
2,3-dimethyl-1-(2-methyltriazol-4-yl)butan-1-one
CID 130603531
[2-chloro-2,2-difluoro-1-(2-methyltriazol-4-yl)ethyl]hydrazine
CID 130603794
2-(5-bromo-2-methoxyphenyl)-1-(2-methyltriazol-4-yl)ethanol
CID 112735939
[(2-methyltriazol-4-yl)-(1H-pyrazol-4-yl)methyl]hydrazine
CID 130603798

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyltriazol-4-yl)ethanol?
The IUPAC name of 1-(2-methyltriazol-4-yl)ethanol (CID 130521764) is 1-(2-methyltriazol-4-yl)ethanol.
What is the SMILES notation for 1-(2-methyltriazol-4-yl)ethanol?
The canonical SMILES for 1-(2-methyltriazol-4-yl)ethanol is CC(O)c1cnn(C)n1.
What is the InChIKey of 1-(2-methyltriazol-4-yl)ethanol?
The InChIKey is OBMUFLIZWCZXGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O/c1-4(9)5-3-6-8(2)7-5/h3-4,9H,1-2H3.
What are the key properties of 1-(2-methyltriazol-4-yl)ethanol?
1-(2-methyltriazol-4-yl)ethanol has a molecular weight of 127.15 g/mol, XLogP of -0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyltriazol-4-yl)ethanol is sourced from PubChem (CID 130521764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).