4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide

C10H16N4O2 — CID 95748088

IUPAC4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide
SMILESCC(=O)Nc1c(C(=O)N(C)C)nn(C)c1C
InChIInChI=1S/C10H16N4O2/c1-6-8(11-7(2)15)9(12-14(6)5)10(16)13(3)4/h1-5H3,(H,11,15)
InChIKeyYFJPIAZQUUXCAF-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.39
Rot. Bonds2

About 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide

4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide (PubChem CID 95748088) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide
PubChem CID95748088
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide
SMILESCC(=O)Nc1c(C(=O)N(C)C)nn(C)c1C
InChIInChI=1S/C10H16N4O2/c1-6-8(11-7(2)15)9(12-14(6)5)10(16)13(3)4/h1-5H3,(H,11,15)
InChIKeyYFJPIAZQUUXCAF-UHFFFAOYSA-N
XLogP0.39
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide?
The IUPAC name of 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide (CID 95748088) is 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide.
What is the SMILES notation for 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide?
The canonical SMILES for 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide is CC(=O)Nc1c(C(=O)N(C)C)nn(C)c1C.
What is the InChIKey of 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide?
The InChIKey is YFJPIAZQUUXCAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-6-8(11-7(2)15)9(12-14(6)5)10(16)13(3)4/h1-5H3,(H,11,15).
What are the key properties of 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide?
4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide is sourced from PubChem (CID 95748088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).