pyrazol-1-amine

C3H5N3 — CID 11829352

IUPACpyrazol-1-amine
SMILESNn1cccn1
InChIInChI=1S/C3H5N3/c4-6-3-1-2-5-6/h1-3H,4H2
InChIKeyNYIGEYYREVRXES-UHFFFAOYSA-N
MW83.09 g/mol
LogP-0.40
Rot. Bonds

About pyrazol-1-amine

pyrazol-1-amine (PubChem CID 11829352) has the molecular formula C3H5N3 and a molecular weight of 83.09 g/mol. Its IUPAC name is pyrazol-1-amine.

Molecular Properties

Compound Namepyrazol-1-amine
PubChem CID11829352
Molecular FormulaC3H5N3
Molecular Weight83.09 g/mol
Exact Mass83.05
IUPAC Namepyrazol-1-amine
SMILESNn1cccn1
InChIInChI=1S/C3H5N3/c4-6-3-1-2-5-6/h1-3H,4H2
InChIKeyNYIGEYYREVRXES-UHFFFAOYSA-N
XLogP-0.40
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50083.09
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of pyrazol-1-amine?
The IUPAC name of pyrazol-1-amine (CID 11829352) is pyrazol-1-amine.
What is the SMILES notation for pyrazol-1-amine?
The canonical SMILES for pyrazol-1-amine is Nn1cccn1.
What is the InChIKey of pyrazol-1-amine?
The InChIKey is NYIGEYYREVRXES-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5N3/c4-6-3-1-2-5-6/h1-3H,4H2.
What are the key properties of pyrazol-1-amine?
pyrazol-1-amine has a molecular weight of 83.09 g/mol, XLogP of -0.40, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazol-1-amine is sourced from PubChem (CID 11829352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).