2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide

C6H7N7O — CID 154414667

IUPAC2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide
SMILESNC(=O)Cn1nnc2ncnc(N)c21
InChIInChI=1S/C6H7N7O/c7-3(14)1-13-4-5(8)9-2-10-6(4)11-12-13/h2H,1H2,(H2,7,14)(H2,8,9,10)
InChIKeyHACZGZMPAYLKHR-UHFFFAOYSA-N
MW193.17 g/mol
LogP-1.71
Rot. Bonds2

About 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide

2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide (PubChem CID 154414667) has the molecular formula C6H7N7O and a molecular weight of 193.17 g/mol. Its IUPAC name is 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide.

Molecular Properties

Compound Name2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide
PubChem CID154414667
Molecular FormulaC6H7N7O
Molecular Weight193.17 g/mol
Exact Mass193.07
IUPAC Name2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide
SMILESNC(=O)Cn1nnc2ncnc(N)c21
InChIInChI=1S/C6H7N7O/c7-3(14)1-13-4-5(8)9-2-10-6(4)11-12-13/h2H,1H2,(H2,7,14)(H2,8,9,10)
InChIKeyHACZGZMPAYLKHR-UHFFFAOYSA-N
XLogP-1.71
TPSA125.60 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.17
LogP ≤ 5-1.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide?
The IUPAC name of 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide (CID 154414667) is 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide.
What is the SMILES notation for 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide?
The canonical SMILES for 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide is NC(=O)Cn1nnc2ncnc(N)c21.
What is the InChIKey of 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide?
The InChIKey is HACZGZMPAYLKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N7O/c7-3(14)1-13-4-5(8)9-2-10-6(4)11-12-13/h2H,1H2,(H2,7,14)(H2,8,9,10).
What are the key properties of 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide?
2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide has a molecular weight of 193.17 g/mol, XLogP of -1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-aminotriazolo[4,5-d]pyrimidin-1-yl)acetamide is sourced from PubChem (CID 154414667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).