5-(tetrazol-1-yl)pentan-1-ol

C6H12N4O — CID 54468065

IUPAC5-(tetrazol-1-yl)pentan-1-ol
SMILESOCCCCCn1cnnn1
InChIInChI=1S/C6H12N4O/c11-5-3-1-2-4-10-6-7-8-9-10/h6,11H,1-5H2
InChIKeySWOBFLMZIIDTFZ-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.16
Rot. Bonds5

About 5-(tetrazol-1-yl)pentan-1-ol

5-(tetrazol-1-yl)pentan-1-ol (PubChem CID 54468065) has the molecular formula C6H12N4O and a molecular weight of 156.19 g/mol. Its IUPAC name is 5-(tetrazol-1-yl)pentan-1-ol.

Molecular Properties

Compound Name5-(tetrazol-1-yl)pentan-1-ol
PubChem CID54468065
Molecular FormulaC6H12N4O
Molecular Weight156.19 g/mol
Exact Mass156.10
IUPAC Name5-(tetrazol-1-yl)pentan-1-ol
SMILESOCCCCCn1cnnn1
InChIInChI=1S/C6H12N4O/c11-5-3-1-2-4-10-6-7-8-9-10/h6,11H,1-5H2
InChIKeySWOBFLMZIIDTFZ-UHFFFAOYSA-N
XLogP-0.16
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(tetrazol-1-yl)pentan-1-ol?
The IUPAC name of 5-(tetrazol-1-yl)pentan-1-ol (CID 54468065) is 5-(tetrazol-1-yl)pentan-1-ol.
What is the SMILES notation for 5-(tetrazol-1-yl)pentan-1-ol?
The canonical SMILES for 5-(tetrazol-1-yl)pentan-1-ol is OCCCCCn1cnnn1.
What is the InChIKey of 5-(tetrazol-1-yl)pentan-1-ol?
The InChIKey is SWOBFLMZIIDTFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O/c11-5-3-1-2-4-10-6-7-8-9-10/h6,11H,1-5H2.
What are the key properties of 5-(tetrazol-1-yl)pentan-1-ol?
5-(tetrazol-1-yl)pentan-1-ol has a molecular weight of 156.19 g/mol, XLogP of -0.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tetrazol-1-yl)pentan-1-ol is sourced from PubChem (CID 54468065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).