3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide

C10H16N4O2 — CID 3035271

IUPAC3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide
SMILESCN(C)C(=O)c1cc(C(=O)N(C)C)n(C)n1
InChIInChI=1S/C10H16N4O2/c1-12(2)9(15)7-6-8(14(5)11-7)10(16)13(3)4/h6H,1-5H3
InChIKeyXGQCQNGYWVWVKE-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.18
Rot. Bonds2

About 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide

3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide (PubChem CID 3035271) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide
PubChem CID3035271
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide
SMILESCN(C)C(=O)c1cc(C(=O)N(C)C)n(C)n1
InChIInChI=1S/C10H16N4O2/c1-12(2)9(15)7-6-8(14(5)11-7)10(16)13(3)4/h6H,1-5H3
InChIKeyXGQCQNGYWVWVKE-UHFFFAOYSA-N
XLogP-0.18
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide?
The IUPAC name of 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide (CID 3035271) is 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide.
What is the SMILES notation for 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide?
The canonical SMILES for 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide is CN(C)C(=O)c1cc(C(=O)N(C)C)n(C)n1.
What is the InChIKey of 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide?
The InChIKey is XGQCQNGYWVWVKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-12(2)9(15)7-6-8(14(5)11-7)10(16)13(3)4/h6H,1-5H3.
What are the key properties of 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide?
3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide has a molecular weight of 224.26 g/mol, XLogP of -0.18, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N,5-N,5-N,1-pentamethylpyrazole-3,5-dicarboxamide is sourced from PubChem (CID 3035271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).