5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine

C9H11N3 — CID 142959926

IUPAC5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine
SMILESC=Cc1c(C)nnnc1/C=C\C
InChIInChI=1S/C9H11N3/c1-4-6-9-8(5-2)7(3)10-12-11-9/h4-6H,2H2,1,3H3/b6-4-
InChIKeyTZVFIPDANYHQPT-XQRVVYSFSA-N
MW161.21 g/mol
LogP1.86
Rot. Bonds2

About 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine

5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine (PubChem CID 142959926) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine.

Molecular Properties

Compound Name5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine
PubChem CID142959926
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine
SMILESC=Cc1c(C)nnnc1/C=C\C
InChIInChI=1S/C9H11N3/c1-4-6-9-8(5-2)7(3)10-12-11-9/h4-6H,2H2,1,3H3/b6-4-
InChIKeyTZVFIPDANYHQPT-XQRVVYSFSA-N
XLogP1.86
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine?
The IUPAC name of 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine (CID 142959926) is 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine.
What is the SMILES notation for 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine?
The canonical SMILES for 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine is C=Cc1c(C)nnnc1/C=C\C.
What is the InChIKey of 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine?
The InChIKey is TZVFIPDANYHQPT-XQRVVYSFSA-N. The full InChI is InChI=1S/C9H11N3/c1-4-6-9-8(5-2)7(3)10-12-11-9/h4-6H,2H2,1,3H3/b6-4-.
What are the key properties of 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine?
5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine has a molecular weight of 161.21 g/mol, XLogP of 1.86, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]triazine is sourced from PubChem (CID 142959926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).