4-ethyl-1H-pyrazol-5-amine

C5H9N3 — CID 11789157

IUPAC4-ethyl-1H-pyrazol-5-amine
SMILESCCc1cn[nH]c1N
InChIInChI=1S/C5H9N3/c1-2-4-3-7-8-5(4)6/h3H,2H2,1H3,(H3,6,7,8)
InChIKeyRDCODVKTTJWFAR-UHFFFAOYSA-N
MW111.15 g/mol
LogP0.55
Rot. Bonds1

About 4-ethyl-1H-pyrazol-5-amine

4-ethyl-1H-pyrazol-5-amine (PubChem CID 11789157) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is 4-ethyl-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-ethyl-1H-pyrazol-5-amine
PubChem CID11789157
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC Name4-ethyl-1H-pyrazol-5-amine
SMILESCCc1cn[nH]c1N
InChIInChI=1S/C5H9N3/c1-2-4-3-7-8-5(4)6/h3H,2H2,1H3,(H3,6,7,8)
InChIKeyRDCODVKTTJWFAR-UHFFFAOYSA-N
XLogP0.55
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1H-pyrazol-5-amine?
The IUPAC name of 4-ethyl-1H-pyrazol-5-amine (CID 11789157) is 4-ethyl-1H-pyrazol-5-amine.
What is the SMILES notation for 4-ethyl-1H-pyrazol-5-amine?
The canonical SMILES for 4-ethyl-1H-pyrazol-5-amine is CCc1cn[nH]c1N.
What is the InChIKey of 4-ethyl-1H-pyrazol-5-amine?
The InChIKey is RDCODVKTTJWFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3/c1-2-4-3-7-8-5(4)6/h3H,2H2,1H3,(H3,6,7,8).
What are the key properties of 4-ethyl-1H-pyrazol-5-amine?
4-ethyl-1H-pyrazol-5-amine has a molecular weight of 111.15 g/mol, XLogP of 0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1H-pyrazol-5-amine is sourced from PubChem (CID 11789157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).