1-(2-thiophen-2-ylethyl)tetrazol-5-amine

C7H9N5S — CID 79506694

IUPAC1-(2-thiophen-2-ylethyl)tetrazol-5-amine
SMILESNc1nnnn1CCc1cccs1
InChIInChI=1S/C7H9N5S/c8-7-9-10-11-12(7)4-3-6-2-1-5-13-6/h1-2,5H,3-4H2,(H2,8,9,11)
InChIKeyONRDQBOVYIAOJB-UHFFFAOYSA-N
MW195.25 g/mol
LogP0.56
Rot. Bonds3

About 1-(2-thiophen-2-ylethyl)tetrazol-5-amine

1-(2-thiophen-2-ylethyl)tetrazol-5-amine (PubChem CID 79506694) has the molecular formula C7H9N5S and a molecular weight of 195.25 g/mol. Its IUPAC name is 1-(2-thiophen-2-ylethyl)tetrazol-5-amine.

Molecular Properties

Compound Name1-(2-thiophen-2-ylethyl)tetrazol-5-amine
PubChem CID79506694
Molecular FormulaC7H9N5S
Molecular Weight195.25 g/mol
Exact Mass195.06
IUPAC Name1-(2-thiophen-2-ylethyl)tetrazol-5-amine
SMILESNc1nnnn1CCc1cccs1
InChIInChI=1S/C7H9N5S/c8-7-9-10-11-12(7)4-3-6-2-1-5-13-6/h1-2,5H,3-4H2,(H2,8,9,11)
InChIKeyONRDQBOVYIAOJB-UHFFFAOYSA-N
XLogP0.56
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.25
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-ethylsulfonylpropan-2-yl)-N-methyl-1-(2-thiophen-2-ylethyl)tetrazol-5-amine
CID 154770223
1-(4-chlorophenyl)-2-[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylethanone
CID 17394088
1-(2-thiophen-2-ylethyl)pyrazol-3-amine
CID 63773628
2-phenyl-4-[[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylmethyl]-1,3-thiazole
CID 24574257
5-methyl-1-(2-thiophen-2-ylethyl)triazole-4-carboxylic acid
CID 63775016
4-[[5-(thiophen-2-ylmethyl)tetrazol-1-yl]methyl]aniline
CID 84759684
2-N-(4-chlorophenyl)-6-[[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine
CID 24572558
2-[5-(3-thiophen-2-ylpropyl)tetrazol-1-yl]acetic acid
CID 66042769
5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-(2-thiophen-2-ylethyl)tetrazole
CID 24574259
1-phenoxy-3-[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylpropan-2-ol
CID 42886752
5-(furan-2-yl)-3-[[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylmethyl]-1,2-oxazole
CID 24574301
4-methyl-2-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-one
CID 86797131

Frequently Asked Questions

What is the IUPAC name of 1-(2-thiophen-2-ylethyl)tetrazol-5-amine?
The IUPAC name of 1-(2-thiophen-2-ylethyl)tetrazol-5-amine (CID 79506694) is 1-(2-thiophen-2-ylethyl)tetrazol-5-amine.
What is the SMILES notation for 1-(2-thiophen-2-ylethyl)tetrazol-5-amine?
The canonical SMILES for 1-(2-thiophen-2-ylethyl)tetrazol-5-amine is Nc1nnnn1CCc1cccs1.
What is the InChIKey of 1-(2-thiophen-2-ylethyl)tetrazol-5-amine?
The InChIKey is ONRDQBOVYIAOJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5S/c8-7-9-10-11-12(7)4-3-6-2-1-5-13-6/h1-2,5H,3-4H2,(H2,8,9,11).
What are the key properties of 1-(2-thiophen-2-ylethyl)tetrazol-5-amine?
1-(2-thiophen-2-ylethyl)tetrazol-5-amine has a molecular weight of 195.25 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-thiophen-2-ylethyl)tetrazol-5-amine is sourced from PubChem (CID 79506694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).