[6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine

C8H8N6 — CID 121370371

IUPAC[6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine
SMILESNCc1ccc(-c2nncnn2)nc1
InChIInChI=1S/C8H8N6/c9-3-6-1-2-7(10-4-6)8-13-11-5-12-14-8/h1-2,4-5H,3,9H2
InChIKeyWPZQKFDDMJIDQS-UHFFFAOYSA-N
MW188.19 g/mol
LogP-0.21
Rot. Bonds2

About [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine

[6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine (PubChem CID 121370371) has the molecular formula C8H8N6 and a molecular weight of 188.19 g/mol. Its IUPAC name is [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine
PubChem CID121370371
Molecular FormulaC8H8N6
Molecular Weight188.19 g/mol
Exact Mass188.08
IUPAC Name[6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine
SMILESNCc1ccc(-c2nncnn2)nc1
InChIInChI=1S/C8H8N6/c9-3-6-1-2-7(10-4-6)8-13-11-5-12-14-8/h1-2,4-5H,3,9H2
InChIKeyWPZQKFDDMJIDQS-UHFFFAOYSA-N
XLogP-0.21
TPSA90.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine?
The IUPAC name of [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine (CID 121370371) is [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine?
The canonical SMILES for [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine is NCc1ccc(-c2nncnn2)nc1.
What is the InChIKey of [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine?
The InChIKey is WPZQKFDDMJIDQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N6/c9-3-6-1-2-7(10-4-6)8-13-11-5-12-14-8/h1-2,4-5H,3,9H2.
What are the key properties of [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine?
[6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine has a molecular weight of 188.19 g/mol, XLogP of -0.21, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 121370371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).