2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide

C10H14N6O2 — CID 39892266

IUPAC2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide
SMILESCc1c2nnn(CC(=O)N(C)C)c(=O)c2nn1C
InChIInChI=1S/C10H14N6O2/c1-6-8-9(12-15(6)4)10(18)16(13-11-8)5-7(17)14(2)3/h5H2,1-4H3
InChIKeyHZISODCMSUEFRA-UHFFFAOYSA-N
MW250.26 g/mol
LogP-1.08
Rot. Bonds2

About 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide

2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide (PubChem CID 39892266) has the molecular formula C10H14N6O2 and a molecular weight of 250.26 g/mol. Its IUPAC name is 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide
PubChem CID39892266
Molecular FormulaC10H14N6O2
Molecular Weight250.26 g/mol
Exact Mass250.12
IUPAC Name2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide
SMILESCc1c2nnn(CC(=O)N(C)C)c(=O)c2nn1C
InChIInChI=1S/C10H14N6O2/c1-6-8-9(12-15(6)4)10(18)16(13-11-8)5-7(17)14(2)3/h5H2,1-4H3
InChIKeyHZISODCMSUEFRA-UHFFFAOYSA-N
XLogP-1.08
TPSA85.91 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 5-1.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide?
The IUPAC name of 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide (CID 39892266) is 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide?
The canonical SMILES for 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide is Cc1c2nnn(CC(=O)N(C)C)c(=O)c2nn1C.
What is the InChIKey of 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide?
The InChIKey is HZISODCMSUEFRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O2/c1-6-8-9(12-15(6)4)10(18)16(13-11-8)5-7(17)14(2)3/h5H2,1-4H3.
What are the key properties of 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide?
2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide has a molecular weight of 250.26 g/mol, XLogP of -1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dimethyl-4-oxopyrazolo[4,3-d]triazin-3-yl)-N,N-dimethylacetamide is sourced from PubChem (CID 39892266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).