[4-(tetrazol-1-yl)cyclohexyl]methanol

C8H14N4O — CID 123336370

IUPAC[4-(tetrazol-1-yl)cyclohexyl]methanol
SMILESOCC1CCC(n2cnnn2)CC1
InChIInChI=1S/C8H14N4O/c13-5-7-1-3-8(4-2-7)12-6-9-10-11-12/h6-8,13H,1-5H2
InChIKeyIUWPUUUFIUNDKM-UHFFFAOYSA-N
MW182.23 g/mol
LogP0.40
Rot. Bonds2

About [4-(tetrazol-1-yl)cyclohexyl]methanol

[4-(tetrazol-1-yl)cyclohexyl]methanol (PubChem CID 123336370) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is [4-(tetrazol-1-yl)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(tetrazol-1-yl)cyclohexyl]methanol
PubChem CID123336370
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name[4-(tetrazol-1-yl)cyclohexyl]methanol
SMILESOCC1CCC(n2cnnn2)CC1
InChIInChI=1S/C8H14N4O/c13-5-7-1-3-8(4-2-7)12-6-9-10-11-12/h6-8,13H,1-5H2
InChIKeyIUWPUUUFIUNDKM-UHFFFAOYSA-N
XLogP0.40
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-(tetrazol-1-yl)cyclohexyl]methanol?
The IUPAC name of [4-(tetrazol-1-yl)cyclohexyl]methanol (CID 123336370) is [4-(tetrazol-1-yl)cyclohexyl]methanol.
What is the SMILES notation for [4-(tetrazol-1-yl)cyclohexyl]methanol?
The canonical SMILES for [4-(tetrazol-1-yl)cyclohexyl]methanol is OCC1CCC(n2cnnn2)CC1.
What is the InChIKey of [4-(tetrazol-1-yl)cyclohexyl]methanol?
The InChIKey is IUWPUUUFIUNDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c13-5-7-1-3-8(4-2-7)12-6-9-10-11-12/h6-8,13H,1-5H2.
What are the key properties of [4-(tetrazol-1-yl)cyclohexyl]methanol?
[4-(tetrazol-1-yl)cyclohexyl]methanol has a molecular weight of 182.23 g/mol, XLogP of 0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(tetrazol-1-yl)cyclohexyl]methanol is sourced from PubChem (CID 123336370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).