2,4,5-trimethylpyrazol-3-amine

C6H11N3 — CID 4737030

IUPAC2,4,5-trimethylpyrazol-3-amine
SMILESCc1nn(C)c(N)c1C
InChIInChI=1S/C6H11N3/c1-4-5(2)8-9(3)6(4)7/h7H2,1-3H3
InChIKeyRXNRZXTWCRTHPR-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.62
Rot. Bonds

About 2,4,5-trimethylpyrazol-3-amine

2,4,5-trimethylpyrazol-3-amine (PubChem CID 4737030) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 2,4,5-trimethylpyrazol-3-amine.

Molecular Properties

Compound Name2,4,5-trimethylpyrazol-3-amine
PubChem CID4737030
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name2,4,5-trimethylpyrazol-3-amine
SMILESCc1nn(C)c(N)c1C
InChIInChI=1S/C6H11N3/c1-4-5(2)8-9(3)6(4)7/h7H2,1-3H3
InChIKeyRXNRZXTWCRTHPR-UHFFFAOYSA-N
XLogP0.62
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethylpyrazol-3-amine?
The IUPAC name of 2,4,5-trimethylpyrazol-3-amine (CID 4737030) is 2,4,5-trimethylpyrazol-3-amine.
What is the SMILES notation for 2,4,5-trimethylpyrazol-3-amine?
The canonical SMILES for 2,4,5-trimethylpyrazol-3-amine is Cc1nn(C)c(N)c1C.
What is the InChIKey of 2,4,5-trimethylpyrazol-3-amine?
The InChIKey is RXNRZXTWCRTHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-4-5(2)8-9(3)6(4)7/h7H2,1-3H3.
What are the key properties of 2,4,5-trimethylpyrazol-3-amine?
2,4,5-trimethylpyrazol-3-amine has a molecular weight of 125.17 g/mol, XLogP of 0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethylpyrazol-3-amine is sourced from PubChem (CID 4737030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).