2-propylpyrazol-3-amine

C6H11N3 — CID 1084923

IUPAC2-propylpyrazol-3-amine
SMILESCCCn1nccc1N
InChIInChI=1S/C6H11N3/c1-2-5-9-6(7)3-4-8-9/h3-4H,2,5,7H2,1H3
InChIKeyOPRZPQAAUXRYDU-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.88
Rot. Bonds2

About 2-propylpyrazol-3-amine

2-propylpyrazol-3-amine (PubChem CID 1084923) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 2-propylpyrazol-3-amine.

Molecular Properties

Compound Name2-propylpyrazol-3-amine
PubChem CID1084923
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name2-propylpyrazol-3-amine
SMILESCCCn1nccc1N
InChIInChI=1S/C6H11N3/c1-2-5-9-6(7)3-4-8-9/h3-4H,2,5,7H2,1H3
InChIKeyOPRZPQAAUXRYDU-UHFFFAOYSA-N
XLogP0.88
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-propylpyrazol-3-amine?
The IUPAC name of 2-propylpyrazol-3-amine (CID 1084923) is 2-propylpyrazol-3-amine.
What is the SMILES notation for 2-propylpyrazol-3-amine?
The canonical SMILES for 2-propylpyrazol-3-amine is CCCn1nccc1N.
What is the InChIKey of 2-propylpyrazol-3-amine?
The InChIKey is OPRZPQAAUXRYDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-2-5-9-6(7)3-4-8-9/h3-4H,2,5,7H2,1H3.
What are the key properties of 2-propylpyrazol-3-amine?
2-propylpyrazol-3-amine has a molecular weight of 125.17 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propylpyrazol-3-amine is sourced from PubChem (CID 1084923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).