2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol

C7H10N6O — CID 130573186

IUPAC2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol
SMILESCn1nnc(CC(O)c2cn[nH]c2)n1
InChIInChI=1S/C7H10N6O/c1-13-11-7(10-12-13)2-6(14)5-3-8-9-4-5/h3-4,6,14H,2H2,1H3,(H,8,9)
InChIKeyJTRISXPEIICRFJ-UHFFFAOYSA-N
MW194.20 g/mol
LogP-0.79
Rot. Bonds3

About 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol

2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol (PubChem CID 130573186) has the molecular formula C7H10N6O and a molecular weight of 194.20 g/mol. Its IUPAC name is 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol
PubChem CID130573186
Molecular FormulaC7H10N6O
Molecular Weight194.20 g/mol
Exact Mass194.09
IUPAC Name2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol
SMILESCn1nnc(CC(O)c2cn[nH]c2)n1
InChIInChI=1S/C7H10N6O/c1-13-11-7(10-12-13)2-6(14)5-3-8-9-4-5/h3-4,6,14H,2H2,1H3,(H,8,9)
InChIKeyJTRISXPEIICRFJ-UHFFFAOYSA-N
XLogP-0.79
TPSA92.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.20
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol?
The IUPAC name of 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol (CID 130573186) is 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol.
What is the SMILES notation for 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol?
The canonical SMILES for 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol is Cn1nnc(CC(O)c2cn[nH]c2)n1.
What is the InChIKey of 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol?
The InChIKey is JTRISXPEIICRFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N6O/c1-13-11-7(10-12-13)2-6(14)5-3-8-9-4-5/h3-4,6,14H,2H2,1H3,(H,8,9).
What are the key properties of 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol?
2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol has a molecular weight of 194.20 g/mol, XLogP of -0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyltetrazol-5-yl)-1-(1H-pyrazol-4-yl)ethanol is sourced from PubChem (CID 130573186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).