[4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol

C11H19N3O — CID 115396722

IUPAC[4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol
SMILESCCn1c(CO)nnc1C1(C)CCCC1
InChIInChI=1S/C11H19N3O/c1-3-14-9(8-15)12-13-10(14)11(2)6-4-5-7-11/h15H,3-8H2,1-2H3
InChIKeyZWZMYXPUYDLULF-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.62
Rot. Bonds3

About [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol

[4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol (PubChem CID 115396722) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol.

Molecular Properties

Compound Name[4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol
PubChem CID115396722
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol
SMILESCCn1c(CO)nnc1C1(C)CCCC1
InChIInChI=1S/C11H19N3O/c1-3-14-9(8-15)12-13-10(14)11(2)6-4-5-7-11/h15H,3-8H2,1-2H3
InChIKeyZWZMYXPUYDLULF-UHFFFAOYSA-N
XLogP1.62
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-tert-butyl-5-(1-methylcyclohexyl)-1,2,4-triazol-3-yl]methanol
CID 106829425
[4-ethyl-5-(2-methyloxolan-2-yl)-1,2,4-triazol-3-yl]methanol
CID 115396606
3-(bromomethyl)-5-(1-methylcyclohexyl)-4-propyl-1,2,4-triazole
CID 106829449
3-(chloromethyl)-5-(1-methylcyclohexyl)-4-propyl-1,2,4-triazole
CID 106829442
2-[[4-ethyl-5-(1-methylcyclohexyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid
CID 106827820
4-ethyl-5-(1-methylcyclohexyl)-1,2,4-triazole-3-sulfonyl chloride
CID 106829481
4-ethyl-3-(1-methylcyclopentyl)-1H-1,2,4-triazole-5-thione
CID 115389531
3-(bromomethyl)-5-(1-methylcyclohexyl)-4-(2-methylpropyl)-1,2,4-triazole
CID 106829451
[4-(2-methylpropyl)-5-[1-(2-methylpropyl)cyclopentyl]-1,2,4-triazol-3-yl]methanol
CID 115397163
3-(chloromethyl)-5-(1-methylcyclopentyl)-4-propan-2-yl-1,2,4-triazole
CID 115397580
1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine
CID 61377993
[5-(3-bicyclo[3.1.0]hexanyl)-4-ethyl-1,2,4-triazol-3-yl]methanol
CID 115396745

Frequently Asked Questions

What is the IUPAC name of [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol?
The IUPAC name of [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol (CID 115396722) is [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol.
What is the SMILES notation for [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol?
The canonical SMILES for [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol is CCn1c(CO)nnc1C1(C)CCCC1.
What is the InChIKey of [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol?
The InChIKey is ZWZMYXPUYDLULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-14-9(8-15)12-13-10(14)11(2)6-4-5-7-11/h15H,3-8H2,1-2H3.
What are the key properties of [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol?
[4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol has a molecular weight of 209.29 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-5-(1-methylcyclopentyl)-1,2,4-triazol-3-yl]methanol is sourced from PubChem (CID 115396722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).