2-(2,5-dimethylphenyl)pyrazol-3-amine

C11H13N3 — CID 43316773

IUPAC2-(2,5-dimethylphenyl)pyrazol-3-amine
SMILESCc1ccc(C)c(-n2nccc2N)c1
InChIInChI=1S/C11H13N3/c1-8-3-4-9(2)10(7-8)14-11(12)5-6-13-14/h3-7H,12H2,1-2H3
InChIKeyNYZZBTXNVAMVGD-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.07
Rot. Bonds1

About 2-(2,5-dimethylphenyl)pyrazol-3-amine

2-(2,5-dimethylphenyl)pyrazol-3-amine (PubChem CID 43316773) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)pyrazol-3-amine.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)pyrazol-3-amine
PubChem CID43316773
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name2-(2,5-dimethylphenyl)pyrazol-3-amine
SMILESCc1ccc(C)c(-n2nccc2N)c1
InChIInChI=1S/C11H13N3/c1-8-3-4-9(2)10(7-8)14-11(12)5-6-13-14/h3-7H,12H2,1-2H3
InChIKeyNYZZBTXNVAMVGD-UHFFFAOYSA-N
XLogP2.07
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)pyrazol-3-amine?
The IUPAC name of 2-(2,5-dimethylphenyl)pyrazol-3-amine (CID 43316773) is 2-(2,5-dimethylphenyl)pyrazol-3-amine.
What is the SMILES notation for 2-(2,5-dimethylphenyl)pyrazol-3-amine?
The canonical SMILES for 2-(2,5-dimethylphenyl)pyrazol-3-amine is Cc1ccc(C)c(-n2nccc2N)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)pyrazol-3-amine?
The InChIKey is NYZZBTXNVAMVGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-8-3-4-9(2)10(7-8)14-11(12)5-6-13-14/h3-7H,12H2,1-2H3.
What are the key properties of 2-(2,5-dimethylphenyl)pyrazol-3-amine?
2-(2,5-dimethylphenyl)pyrazol-3-amine has a molecular weight of 187.25 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)pyrazol-3-amine is sourced from PubChem (CID 43316773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).