(E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine

C10H11N5 — CID 6450955

IUPAC(E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine
SMILESCN(C)/C=C/c1nnc2ccncc2n1
InChIInChI=1S/C10H11N5/c1-15(2)6-4-10-12-9-7-11-5-3-8(9)13-14-10/h3-7H,1-2H3/b6-4+
InChIKeyGZFCUMKNRGGNTH-GQCTYLIASA-N
MW201.23 g/mol
LogP0.95
Rot. Bonds2

About (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine

(E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine (PubChem CID 6450955) has the molecular formula C10H11N5 and a molecular weight of 201.23 g/mol. Its IUPAC name is (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine.

Molecular Properties

Compound Name(E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine
PubChem CID6450955
Molecular FormulaC10H11N5
Molecular Weight201.23 g/mol
Exact Mass201.10
IUPAC Name(E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine
SMILESCN(C)/C=C/c1nnc2ccncc2n1
InChIInChI=1S/C10H11N5/c1-15(2)6-4-10-12-9-7-11-5-3-8(9)13-14-10/h3-7H,1-2H3/b6-4+
InChIKeyGZFCUMKNRGGNTH-GQCTYLIASA-N
XLogP0.95
TPSA54.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine?
The IUPAC name of (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine (CID 6450955) is (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine.
What is the SMILES notation for (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine?
The canonical SMILES for (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine is CN(C)/C=C/c1nnc2ccncc2n1.
What is the InChIKey of (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine?
The InChIKey is GZFCUMKNRGGNTH-GQCTYLIASA-N. The full InChI is InChI=1S/C10H11N5/c1-15(2)6-4-10-12-9-7-11-5-3-8(9)13-14-10/h3-7H,1-2H3/b6-4+.
What are the key properties of (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine?
(E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine has a molecular weight of 201.23 g/mol, XLogP of 0.95, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-dimethyl-2-pyrido[3,4-e][1,2,4]triazin-3-ylethenamine is sourced from PubChem (CID 6450955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).