N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide

C8H9N5OS — CID 2215355

IUPACN-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide
SMILESCCn1nnc(NC(=O)c2cccs2)n1
InChIInChI=1S/C8H9N5OS/c1-2-13-11-8(10-12-13)9-7(14)6-4-3-5-15-6/h3-5H,2H2,1H3,(H,9,11,14)
InChIKeyZYKKUUSFFJTRPG-UHFFFAOYSA-N
MW223.26 g/mol
LogP1.01
Rot. Bonds3

About N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide

N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide (PubChem CID 2215355) has the molecular formula C8H9N5OS and a molecular weight of 223.26 g/mol. Its IUPAC name is N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide
PubChem CID2215355
Molecular FormulaC8H9N5OS
Molecular Weight223.26 g/mol
Exact Mass223.05
IUPAC NameN-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide
SMILESCCn1nnc(NC(=O)c2cccs2)n1
InChIInChI=1S/C8H9N5OS/c1-2-13-11-8(10-12-13)9-7(14)6-4-3-5-15-6/h3-5H,2H2,1H3,(H,9,11,14)
InChIKeyZYKKUUSFFJTRPG-UHFFFAOYSA-N
XLogP1.01
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.26
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide?
The IUPAC name of N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide (CID 2215355) is N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide is CCn1nnc(NC(=O)c2cccs2)n1.
What is the InChIKey of N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide?
The InChIKey is ZYKKUUSFFJTRPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5OS/c1-2-13-11-8(10-12-13)9-7(14)6-4-3-5-15-6/h3-5H,2H2,1H3,(H,9,11,14).
What are the key properties of N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide?
N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide has a molecular weight of 223.26 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyltetrazol-5-yl)thiophene-2-carboxamide is sourced from PubChem (CID 2215355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).