4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide

C7H5N7O — CID 15361543

IUPAC4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide
SMILESN#Cc1ncn2c(N)c(C(N)=O)nnc12
InChIInChI=1S/C7H5N7O/c8-1-3-7-13-12-4(6(10)15)5(9)14(7)2-11-3/h2H,9H2,(H2,10,15)
InChIKeyNQSXIWONDVPJOQ-UHFFFAOYSA-N
MW203.17 g/mol
LogP-1.32
Rot. Bonds1

About 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide

4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide (PubChem CID 15361543) has the molecular formula C7H5N7O and a molecular weight of 203.17 g/mol. Its IUPAC name is 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide.

Molecular Properties

Compound Name4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide
PubChem CID15361543
Molecular FormulaC7H5N7O
Molecular Weight203.17 g/mol
Exact Mass203.06
IUPAC Name4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide
SMILESN#Cc1ncn2c(N)c(C(N)=O)nnc12
InChIInChI=1S/C7H5N7O/c8-1-3-7-13-12-4(6(10)15)5(9)14(7)2-11-3/h2H,9H2,(H2,10,15)
InChIKeyNQSXIWONDVPJOQ-UHFFFAOYSA-N
XLogP-1.32
TPSA135.98 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.17
LogP ≤ 5-1.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide?
The IUPAC name of 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide (CID 15361543) is 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide.
What is the SMILES notation for 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide?
The canonical SMILES for 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide is N#Cc1ncn2c(N)c(C(N)=O)nnc12.
What is the InChIKey of 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide?
The InChIKey is NQSXIWONDVPJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N7O/c8-1-3-7-13-12-4(6(10)15)5(9)14(7)2-11-3/h2H,9H2,(H2,10,15).
What are the key properties of 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide?
4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide has a molecular weight of 203.17 g/mol, XLogP of -1.32, 1 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-8-cyanoimidazo[5,1-c][1,2,4]triazine-3-carboxamide is sourced from PubChem (CID 15361543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).