2-propyl-6-(tetrazol-1-yl)pyrazine

C8H10N6 — CID 130450815

IUPAC2-propyl-6-(tetrazol-1-yl)pyrazine
SMILESCCCc1cncc(-n2cnnn2)n1
InChIInChI=1S/C8H10N6/c1-2-3-7-4-9-5-8(11-7)14-6-10-12-13-14/h4-6H,2-3H2,1H3
InChIKeyNEYSHJPUEZYQGG-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.40
Rot. Bonds3

About 2-propyl-6-(tetrazol-1-yl)pyrazine

2-propyl-6-(tetrazol-1-yl)pyrazine (PubChem CID 130450815) has the molecular formula C8H10N6 and a molecular weight of 190.21 g/mol. Its IUPAC name is 2-propyl-6-(tetrazol-1-yl)pyrazine.

Molecular Properties

Compound Name2-propyl-6-(tetrazol-1-yl)pyrazine
PubChem CID130450815
Molecular FormulaC8H10N6
Molecular Weight190.21 g/mol
Exact Mass190.10
IUPAC Name2-propyl-6-(tetrazol-1-yl)pyrazine
SMILESCCCc1cncc(-n2cnnn2)n1
InChIInChI=1S/C8H10N6/c1-2-3-7-4-9-5-8(11-7)14-6-10-12-13-14/h4-6H,2-3H2,1H3
InChIKeyNEYSHJPUEZYQGG-UHFFFAOYSA-N
XLogP0.40
TPSA69.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-propyl-6-(tetrazol-1-yl)pyrazine?
The IUPAC name of 2-propyl-6-(tetrazol-1-yl)pyrazine (CID 130450815) is 2-propyl-6-(tetrazol-1-yl)pyrazine.
What is the SMILES notation for 2-propyl-6-(tetrazol-1-yl)pyrazine?
The canonical SMILES for 2-propyl-6-(tetrazol-1-yl)pyrazine is CCCc1cncc(-n2cnnn2)n1.
What is the InChIKey of 2-propyl-6-(tetrazol-1-yl)pyrazine?
The InChIKey is NEYSHJPUEZYQGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6/c1-2-3-7-4-9-5-8(11-7)14-6-10-12-13-14/h4-6H,2-3H2,1H3.
What are the key properties of 2-propyl-6-(tetrazol-1-yl)pyrazine?
2-propyl-6-(tetrazol-1-yl)pyrazine has a molecular weight of 190.21 g/mol, XLogP of 0.40, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-6-(tetrazol-1-yl)pyrazine is sourced from PubChem (CID 130450815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).