(5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine

C14H20N4 — CID 144548796

IUPAC(5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine
SMILESC/C=c1/nc(C)c2nnc(CCC)n2/c1=C/CC
InChIInChI=1S/C14H20N4/c1-5-8-12-11(7-3)15-10(4)14-17-16-13(9-6-2)18(12)14/h7-8H,5-6,9H2,1-4H3/b11-7+,12-8+
InChIKeyFYCGQOGVHMNCMY-MKICQXMISA-N
MW244.34 g/mol
LogP1.38
Rot. Bonds3

About (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine

(5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 144548796) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name(5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID144548796
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name(5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine
SMILESC/C=c1/nc(C)c2nnc(CCC)n2/c1=C/CC
InChIInChI=1S/C14H20N4/c1-5-8-12-11(7-3)15-10(4)14-17-16-13(9-6-2)18(12)14/h7-8H,5-6,9H2,1-4H3/b11-7+,12-8+
InChIKeyFYCGQOGVHMNCMY-MKICQXMISA-N
XLogP1.38
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine with MolForge

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Related Compounds

(8Z)-8-ethylidene-2,6,7-trimethyl-5-methylidene-[1,2,4]triazolo[1,5-a]pyridine
CID 60042571
5,6-Bis(ethenyl)-3-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123240038
5-Ethenyl-3,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123987415
ethane;(5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine
CID 144548795
(3E)-3-[(5E,6E)-6-ethylidene-8-methyl-5-prop-2-enylidene-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-methylhexa-3,5-dien-2-imine
CID 144548803
4-Cyclohexa-1,5-dien-1-yl-3,5-dimethyl-1,2,4-triazole;ethane
CID 144668192
4-Cyclohexa-1,5-dien-1-yl-3,5-dimethyl-1,2,4-triazole;ethane
CID 144668194
4-Cyclohexa-1,5-dien-1-yl-3,5-dimethyl-1,2,4-triazole
CID 144668193

Frequently Asked Questions

What is the IUPAC name of (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine (CID 144548796) is (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine is C/C=c1/nc(C)c2nnc(CCC)n2/c1=C/CC.
What is the InChIKey of (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is FYCGQOGVHMNCMY-MKICQXMISA-N. The full InChI is InChI=1S/C14H20N4/c1-5-8-12-11(7-3)15-10(4)14-17-16-13(9-6-2)18(12)14/h7-8H,5-6,9H2,1-4H3/b11-7+,12-8+.
What are the key properties of (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine?
(5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 244.34 g/mol, XLogP of 1.38, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,6E)-6-ethylidene-8-methyl-3-propyl-5-propylidene-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 144548796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).