1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol

C9H14N6O — CID 107065836

IUPAC1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol
SMILESCc1cc(C(O)Cc2nnn(C)n2)n(C)n1
InChIInChI=1S/C9H14N6O/c1-6-4-7(14(2)11-6)8(16)5-9-10-13-15(3)12-9/h4,8,16H,5H2,1-3H3
InChIKeyRPTANOIORKTZJE-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.47
Rot. Bonds3

About 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol

1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol (PubChem CID 107065836) has the molecular formula C9H14N6O and a molecular weight of 222.25 g/mol. Its IUPAC name is 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol.

Molecular Properties

Compound Name1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol
PubChem CID107065836
Molecular FormulaC9H14N6O
Molecular Weight222.25 g/mol
Exact Mass222.12
IUPAC Name1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol
SMILESCc1cc(C(O)Cc2nnn(C)n2)n(C)n1
InChIInChI=1S/C9H14N6O/c1-6-4-7(14(2)11-6)8(16)5-9-10-13-15(3)12-9/h4,8,16H,5H2,1-3H3
InChIKeyRPTANOIORKTZJE-UHFFFAOYSA-N
XLogP-0.47
TPSA81.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107065432
1-(2,5-dimethylpyrazol-3-yl)-2-(4-fluorophenyl)ethanol
CID 105077036
1-(4-methylphenyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107045900
1-(2,5-dimethylthiophen-3-yl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107045984
3-amino-1-(2,5-dimethylpyrazol-3-yl)propan-1-ol
CID 82598009
1-(2-iodo-3-methylphenyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 114030498
1-(2,5-dimethylpyrazol-3-yl)-5-methylhexan-1-ol
CID 105122769
1-(2,5-dimethylpyrazol-3-yl)-3-ethylpentan-1-ol
CID 105122554
1-(2,5-dimethylpyrazol-3-yl)-2-(furan-2-yl)ethanol
CID 105122958
2-(3-chloro-4-fluorophenyl)-1-(2,5-dimethylpyrazol-3-yl)ethanol
CID 103043648
1-(3-chloro-4-methylthiophen-2-yl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107065771
2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(2,5-dimethylpyrazol-3-yl)ethanol
CID 105105694

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol?
The IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol (CID 107065836) is 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol.
What is the SMILES notation for 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol?
The canonical SMILES for 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol is Cc1cc(C(O)Cc2nnn(C)n2)n(C)n1.
What is the InChIKey of 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol?
The InChIKey is RPTANOIORKTZJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N6O/c1-6-4-7(14(2)11-6)8(16)5-9-10-13-15(3)12-9/h4,8,16H,5H2,1-3H3.
What are the key properties of 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol?
1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol has a molecular weight of 222.25 g/mol, XLogP of -0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol is sourced from PubChem (CID 107065836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).