2-(5-methyltetrazol-2-yl)ethanol

C4H8N4O — CID 59496883

IUPAC2-(5-methyltetrazol-2-yl)ethanol
SMILESCc1nnn(CCO)n1
InChIInChI=1S/C4H8N4O/c1-4-5-7-8(6-4)2-3-9/h9H,2-3H2,1H3
InChIKeyJXJBEDDZLMGYES-UHFFFAOYSA-N
MW128.13 g/mol
LogP-1.03
Rot. Bonds2

About 2-(5-methyltetrazol-2-yl)ethanol

2-(5-methyltetrazol-2-yl)ethanol (PubChem CID 59496883) has the molecular formula C4H8N4O and a molecular weight of 128.13 g/mol. Its IUPAC name is 2-(5-methyltetrazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(5-methyltetrazol-2-yl)ethanol
PubChem CID59496883
Molecular FormulaC4H8N4O
Molecular Weight128.13 g/mol
Exact Mass128.07
IUPAC Name2-(5-methyltetrazol-2-yl)ethanol
SMILESCc1nnn(CCO)n1
InChIInChI=1S/C4H8N4O/c1-4-5-7-8(6-4)2-3-9/h9H,2-3H2,1H3
InChIKeyJXJBEDDZLMGYES-UHFFFAOYSA-N
XLogP-1.03
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 5-1.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyltetrazol-2-yl)ethanol?
The IUPAC name of 2-(5-methyltetrazol-2-yl)ethanol (CID 59496883) is 2-(5-methyltetrazol-2-yl)ethanol.
What is the SMILES notation for 2-(5-methyltetrazol-2-yl)ethanol?
The canonical SMILES for 2-(5-methyltetrazol-2-yl)ethanol is Cc1nnn(CCO)n1.
What is the InChIKey of 2-(5-methyltetrazol-2-yl)ethanol?
The InChIKey is JXJBEDDZLMGYES-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4O/c1-4-5-7-8(6-4)2-3-9/h9H,2-3H2,1H3.
What are the key properties of 2-(5-methyltetrazol-2-yl)ethanol?
2-(5-methyltetrazol-2-yl)ethanol has a molecular weight of 128.13 g/mol, XLogP of -1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyltetrazol-2-yl)ethanol is sourced from PubChem (CID 59496883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).