1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine

C6H10N4 — CID 170025272

IUPAC1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine
SMILESC=Cc1ncnn1CNC
InChIInChI=1S/C6H10N4/c1-3-6-8-4-9-10(6)5-7-2/h3-4,7H,1,5H2,2H3
InChIKeyABOSZXYWFMDOAQ-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.10
Rot. Bonds3

About 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine

1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine (PubChem CID 170025272) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine
PubChem CID170025272
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine
SMILESC=Cc1ncnn1CNC
InChIInChI=1S/C6H10N4/c1-3-6-8-4-9-10(6)5-7-2/h3-4,7H,1,5H2,2H3
InChIKeyABOSZXYWFMDOAQ-UHFFFAOYSA-N
XLogP0.10
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine (CID 170025272) is 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine is C=Cc1ncnn1CNC.
What is the InChIKey of 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine?
The InChIKey is ABOSZXYWFMDOAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4/c1-3-6-8-4-9-10(6)5-7-2/h3-4,7H,1,5H2,2H3.
What are the key properties of 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine?
1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine has a molecular weight of 138.17 g/mol, XLogP of 0.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethenyl-1,2,4-triazol-1-yl)-N-methylmethanamine is sourced from PubChem (CID 170025272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).