1-(5-ethyltetrazol-1-yl)butan-1-ol

C7H14N4O — CID 137470685

IUPAC1-(5-ethyltetrazol-1-yl)butan-1-ol
SMILESCCCC(O)n1nnnc1CC
InChIInChI=1S/C7H14N4O/c1-3-5-7(12)11-6(4-2)8-9-10-11/h7,12H,3-5H2,1-2H3
InChIKeyMZYMCQXWJGVMKM-UHFFFAOYSA-N
MW170.22 g/mol
LogP0.53
Rot. Bonds4

About 1-(5-ethyltetrazol-1-yl)butan-1-ol

1-(5-ethyltetrazol-1-yl)butan-1-ol (PubChem CID 137470685) has the molecular formula C7H14N4O and a molecular weight of 170.22 g/mol. Its IUPAC name is 1-(5-ethyltetrazol-1-yl)butan-1-ol.

Molecular Properties

Compound Name1-(5-ethyltetrazol-1-yl)butan-1-ol
PubChem CID137470685
Molecular FormulaC7H14N4O
Molecular Weight170.22 g/mol
Exact Mass170.12
IUPAC Name1-(5-ethyltetrazol-1-yl)butan-1-ol
SMILESCCCC(O)n1nnnc1CC
InChIInChI=1S/C7H14N4O/c1-3-5-7(12)11-6(4-2)8-9-10-11/h7,12H,3-5H2,1-2H3
InChIKeyMZYMCQXWJGVMKM-UHFFFAOYSA-N
XLogP0.53
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.22
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(5-ethyltetrazol-1-yl)butan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyltetrazol-1-yl)butan-1-ol?
The IUPAC name of 1-(5-ethyltetrazol-1-yl)butan-1-ol (CID 137470685) is 1-(5-ethyltetrazol-1-yl)butan-1-ol.
What is the SMILES notation for 1-(5-ethyltetrazol-1-yl)butan-1-ol?
The canonical SMILES for 1-(5-ethyltetrazol-1-yl)butan-1-ol is CCCC(O)n1nnnc1CC.
What is the InChIKey of 1-(5-ethyltetrazol-1-yl)butan-1-ol?
The InChIKey is MZYMCQXWJGVMKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O/c1-3-5-7(12)11-6(4-2)8-9-10-11/h7,12H,3-5H2,1-2H3.
What are the key properties of 1-(5-ethyltetrazol-1-yl)butan-1-ol?
1-(5-ethyltetrazol-1-yl)butan-1-ol has a molecular weight of 170.22 g/mol, XLogP of 0.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyltetrazol-1-yl)butan-1-ol is sourced from PubChem (CID 137470685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).