1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol

C8H10N4OS — CID 127004646

IUPAC1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol
SMILESCn1nnc(C(O)Cc2cccs2)n1
InChIInChI=1S/C8H10N4OS/c1-12-10-8(9-11-12)7(13)5-6-3-2-4-14-6/h2-4,7,13H,5H2,1H3
InChIKeyOUEXHADJEHVEOA-UHFFFAOYSA-N
MW210.26 g/mol
LogP0.55
Rot. Bonds3

About 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol

1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol (PubChem CID 127004646) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol
PubChem CID127004646
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol
SMILESCn1nnc(C(O)Cc2cccs2)n1
InChIInChI=1S/C8H10N4OS/c1-12-10-8(9-11-12)7(13)5-6-3-2-4-14-6/h2-4,7,13H,5H2,1H3
InChIKeyOUEXHADJEHVEOA-UHFFFAOYSA-N
XLogP0.55
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-methyltetrazol-5-yl)-2-(thiophen-2-ylmethylamino)ethanol chloride
CID 53314595
1-(1,3-dimethylpyrazol-4-yl)-2-thiophen-2-ylethanol
CID 83091790
1-(1-methylpyrazol-4-yl)-2-thiophen-2-ylethanol
CID 62501851
1-(1-methylindazol-3-yl)-2-thiophen-2-ylethanol
CID 103128674
1-(2,6-dimethyl-4-pyridinyl)-2-thiophen-2-ylethanol
CID 107502914
1-(1-methylimidazol-4-yl)-3-thiophen-2-ylpropan-1-ol
CID 107978387
3,3-dimethyl-2-(thiophen-2-ylmethyl)butan-1-ol
CID 83138477
1-(6-methyl-3-pyridinyl)-2-thiophen-2-ylethanol
CID 63155413
1-(3-cyclopropylimidazol-4-yl)-2-thiophen-2-ylethanol
CID 66139860
1-(3,4-dimethoxyphenyl)-2-thiophen-2-ylethanol
CID 55136258
1-(diethylamino)-3-thiophen-2-ylpropan-2-ol
CID 121219027
1-(4-methoxyphenyl)-2-thiophen-2-ylethanol
CID 62501005

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol?
The IUPAC name of 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol (CID 127004646) is 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol.
What is the SMILES notation for 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol?
The canonical SMILES for 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol is Cn1nnc(C(O)Cc2cccs2)n1.
What is the InChIKey of 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol?
The InChIKey is OUEXHADJEHVEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4OS/c1-12-10-8(9-11-12)7(13)5-6-3-2-4-14-6/h2-4,7,13H,5H2,1H3.
What are the key properties of 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol?
1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol has a molecular weight of 210.26 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyltetrazol-5-yl)-2-thiophen-2-ylethanol is sourced from PubChem (CID 127004646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).