2-(1-cyclohexyltetrazol-5-yl)ethanol

C9H16N4O — CID 21460051

IUPAC2-(1-cyclohexyltetrazol-5-yl)ethanol
SMILESOCCc1nnnn1C1CCCCC1
InChIInChI=1S/C9H16N4O/c14-7-6-9-10-11-12-13(9)8-4-2-1-3-5-8/h8,14H,1-7H2
InChIKeyWMYGFYLEYBJNJY-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.71
Rot. Bonds3

About 2-(1-cyclohexyltetrazol-5-yl)ethanol

2-(1-cyclohexyltetrazol-5-yl)ethanol (PubChem CID 21460051) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-(1-cyclohexyltetrazol-5-yl)ethanol.

Molecular Properties

Compound Name2-(1-cyclohexyltetrazol-5-yl)ethanol
PubChem CID21460051
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name2-(1-cyclohexyltetrazol-5-yl)ethanol
SMILESOCCc1nnnn1C1CCCCC1
InChIInChI=1S/C9H16N4O/c14-7-6-9-10-11-12-13(9)8-4-2-1-3-5-8/h8,14H,1-7H2
InChIKeyWMYGFYLEYBJNJY-UHFFFAOYSA-N
XLogP0.71
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexyltetrazol-5-yl)ethanol?
The IUPAC name of 2-(1-cyclohexyltetrazol-5-yl)ethanol (CID 21460051) is 2-(1-cyclohexyltetrazol-5-yl)ethanol.
What is the SMILES notation for 2-(1-cyclohexyltetrazol-5-yl)ethanol?
The canonical SMILES for 2-(1-cyclohexyltetrazol-5-yl)ethanol is OCCc1nnnn1C1CCCCC1.
What is the InChIKey of 2-(1-cyclohexyltetrazol-5-yl)ethanol?
The InChIKey is WMYGFYLEYBJNJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c14-7-6-9-10-11-12-13(9)8-4-2-1-3-5-8/h8,14H,1-7H2.
What are the key properties of 2-(1-cyclohexyltetrazol-5-yl)ethanol?
2-(1-cyclohexyltetrazol-5-yl)ethanol has a molecular weight of 196.25 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexyltetrazol-5-yl)ethanol is sourced from PubChem (CID 21460051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).