4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine

C10H7N5S — CID 66857019

IUPAC4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine
SMILESc1cc(-c2ccc(-c3nn[nH]n3)s2)ccn1
InChIInChI=1S/C10H7N5S/c1-2-9(10-12-14-15-13-10)16-8(1)7-3-5-11-6-4-7/h1-6H,(H,12,13,14,15)
InChIKeyFKGUNOYHNVXJRE-UHFFFAOYSA-N
MW229.27 g/mol
LogP1.99
Rot. Bonds2

About 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine

4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine (PubChem CID 66857019) has the molecular formula C10H7N5S and a molecular weight of 229.27 g/mol. Its IUPAC name is 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine.

Molecular Properties

Compound Name4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine
PubChem CID66857019
Molecular FormulaC10H7N5S
Molecular Weight229.27 g/mol
Exact Mass229.04
IUPAC Name4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine
SMILESc1cc(-c2ccc(-c3nn[nH]n3)s2)ccn1
InChIInChI=1S/C10H7N5S/c1-2-9(10-12-14-15-13-10)16-8(1)7-3-5-11-6-4-7/h1-6H,(H,12,13,14,15)
InChIKeyFKGUNOYHNVXJRE-UHFFFAOYSA-N
XLogP1.99
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.27
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine?
The IUPAC name of 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine (CID 66857019) is 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine.
What is the SMILES notation for 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine?
The canonical SMILES for 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine is c1cc(-c2ccc(-c3nn[nH]n3)s2)ccn1.
What is the InChIKey of 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine?
The InChIKey is FKGUNOYHNVXJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N5S/c1-2-9(10-12-14-15-13-10)16-8(1)7-3-5-11-6-4-7/h1-6H,(H,12,13,14,15).
What are the key properties of 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine?
4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine has a molecular weight of 229.27 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(2H-tetrazol-5-yl)thiophen-2-yl]pyridine is sourced from PubChem (CID 66857019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).