6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C10H10N4O2 — CID 12680693

IUPAC6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1cnn2cc(C(C)=O)cnc12
InChIInChI=1S/C10H10N4O2/c1-6(15)7-3-12-9-8(10(16)11-2)4-13-14(9)5-7/h3-5H,1-2H3,(H,11,16)
InChIKeyNFWKGAABPQWXOC-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.29
Rot. Bonds2

About 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 12680693) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID12680693
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC Name6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1cnn2cc(C(C)=O)cnc12
InChIInChI=1S/C10H10N4O2/c1-6(15)7-3-12-9-8(10(16)11-2)4-13-14(9)5-7/h3-5H,1-2H3,(H,11,16)
InChIKeyNFWKGAABPQWXOC-UHFFFAOYSA-N
XLogP0.29
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 12680693) is 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is CNC(=O)c1cnn2cc(C(C)=O)cnc12.
What is the InChIKey of 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is NFWKGAABPQWXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-6(15)7-3-12-9-8(10(16)11-2)4-13-14(9)5-7/h3-5H,1-2H3,(H,11,16).
What are the key properties of 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 218.22 g/mol, XLogP of 0.29, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetyl-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 12680693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).