N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide

C9H11N5O — CID 134337608

IUPACN-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide
SMILESCC(=O)Nc1nn(C)c2cnc(C)nc12
InChIInChI=1S/C9H11N5O/c1-5-10-4-7-8(11-5)9(12-6(2)15)13-14(7)3/h4H,1-3H3,(H,12,13,15)
InChIKeyBLTUJMABNFIQGC-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.63
Rot. Bonds1

About N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide

N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide (PubChem CID 134337608) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide
PubChem CID134337608
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC NameN-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide
SMILESCC(=O)Nc1nn(C)c2cnc(C)nc12
InChIInChI=1S/C9H11N5O/c1-5-10-4-7-8(11-5)9(12-6(2)15)13-14(7)3/h4H,1-3H3,(H,12,13,15)
InChIKeyBLTUJMABNFIQGC-UHFFFAOYSA-N
XLogP0.63
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide?
The IUPAC name of N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide (CID 134337608) is N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide.
What is the SMILES notation for N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide?
The canonical SMILES for N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide is CC(=O)Nc1nn(C)c2cnc(C)nc12.
What is the InChIKey of N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide?
The InChIKey is BLTUJMABNFIQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c1-5-10-4-7-8(11-5)9(12-6(2)15)13-14(7)3/h4H,1-3H3,(H,12,13,15).
What are the key properties of N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide?
N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide has a molecular weight of 205.22 g/mol, XLogP of 0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazolo[4,3-d]pyrimidin-3-yl)acetamide is sourced from PubChem (CID 134337608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).