2,5-dimethylpyrazol-3-amine

C5H9N3 — CID 520721

IUPAC2,5-dimethylpyrazol-3-amine
SMILESCc1cc(N)n(C)n1
InChIInChI=1S/C5H9N3/c1-4-3-5(6)8(2)7-4/h3H,6H2,1-2H3
InChIKeyZFDGMMZLXSFNFU-UHFFFAOYSA-N
MW111.15 g/mol
LogP0.31
Rot. Bonds

About 2,5-dimethylpyrazol-3-amine

2,5-dimethylpyrazol-3-amine (PubChem CID 520721) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is 2,5-dimethylpyrazol-3-amine.

Molecular Properties

Compound Name2,5-dimethylpyrazol-3-amine
PubChem CID520721
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC Name2,5-dimethylpyrazol-3-amine
SMILESCc1cc(N)n(C)n1
InChIInChI=1S/C5H9N3/c1-4-3-5(6)8(2)7-4/h3H,6H2,1-2H3
InChIKeyZFDGMMZLXSFNFU-UHFFFAOYSA-N
XLogP0.31
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyrazol-3-amine?
The IUPAC name of 2,5-dimethylpyrazol-3-amine (CID 520721) is 2,5-dimethylpyrazol-3-amine.
What is the SMILES notation for 2,5-dimethylpyrazol-3-amine?
The canonical SMILES for 2,5-dimethylpyrazol-3-amine is Cc1cc(N)n(C)n1.
What is the InChIKey of 2,5-dimethylpyrazol-3-amine?
The InChIKey is ZFDGMMZLXSFNFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3/c1-4-3-5(6)8(2)7-4/h3H,6H2,1-2H3.
What are the key properties of 2,5-dimethylpyrazol-3-amine?
2,5-dimethylpyrazol-3-amine has a molecular weight of 111.15 g/mol, XLogP of 0.31, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpyrazol-3-amine is sourced from PubChem (CID 520721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).