5-ethenyl-1H-pyrazol-3-amine

C5H7N3 — CID 144709176

IUPAC5-ethenyl-1H-pyrazol-3-amine
SMILESC=Cc1cc(N)n[nH]1
InChIInChI=1S/C5H7N3/c1-2-4-3-5(6)8-7-4/h2-3H,1H2,(H3,6,7,8)
InChIKeyOPXBQOZCTVWYGG-UHFFFAOYSA-N
MW109.13 g/mol
LogP0.63
Rot. Bonds1

About 5-ethenyl-1H-pyrazol-3-amine

5-ethenyl-1H-pyrazol-3-amine (PubChem CID 144709176) has the molecular formula C5H7N3 and a molecular weight of 109.13 g/mol. Its IUPAC name is 5-ethenyl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-ethenyl-1H-pyrazol-3-amine
PubChem CID144709176
Molecular FormulaC5H7N3
Molecular Weight109.13 g/mol
Exact Mass109.06
IUPAC Name5-ethenyl-1H-pyrazol-3-amine
SMILESC=Cc1cc(N)n[nH]1
InChIInChI=1S/C5H7N3/c1-2-4-3-5(6)8-7-4/h2-3H,1H2,(H3,6,7,8)
InChIKeyOPXBQOZCTVWYGG-UHFFFAOYSA-N
XLogP0.63
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-1H-pyrazol-3-amine?
The IUPAC name of 5-ethenyl-1H-pyrazol-3-amine (CID 144709176) is 5-ethenyl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-ethenyl-1H-pyrazol-3-amine?
The canonical SMILES for 5-ethenyl-1H-pyrazol-3-amine is C=Cc1cc(N)n[nH]1.
What is the InChIKey of 5-ethenyl-1H-pyrazol-3-amine?
The InChIKey is OPXBQOZCTVWYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3/c1-2-4-3-5(6)8-7-4/h2-3H,1H2,(H3,6,7,8).
What are the key properties of 5-ethenyl-1H-pyrazol-3-amine?
5-ethenyl-1H-pyrazol-3-amine has a molecular weight of 109.13 g/mol, XLogP of 0.63, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-1H-pyrazol-3-amine is sourced from PubChem (CID 144709176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).