3-methylpyrazolidin-1-amine

C4H11N3 — CID 174846539

IUPAC3-methylpyrazolidin-1-amine
SMILESCC1CCN(N)N1
InChIInChI=1S/C4H11N3/c1-4-2-3-7(5)6-4/h4,6H,2-3,5H2,1H3
InChIKeyGBTFROWNOGYSJE-UHFFFAOYSA-N
MW101.15 g/mol
LogP-0.54
Rot. Bonds

About 3-methylpyrazolidin-1-amine

3-methylpyrazolidin-1-amine (PubChem CID 174846539) has the molecular formula C4H11N3 and a molecular weight of 101.15 g/mol. Its IUPAC name is 3-methylpyrazolidin-1-amine.

Molecular Properties

Compound Name3-methylpyrazolidin-1-amine
PubChem CID174846539
Molecular FormulaC4H11N3
Molecular Weight101.15 g/mol
Exact Mass101.10
IUPAC Name3-methylpyrazolidin-1-amine
SMILESCC1CCN(N)N1
InChIInChI=1S/C4H11N3/c1-4-2-3-7(5)6-4/h4,6H,2-3,5H2,1H3
InChIKeyGBTFROWNOGYSJE-UHFFFAOYSA-N
XLogP-0.54
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-methylpyrazolidin-1-amine?
The IUPAC name of 3-methylpyrazolidin-1-amine (CID 174846539) is 3-methylpyrazolidin-1-amine.
What is the SMILES notation for 3-methylpyrazolidin-1-amine?
The canonical SMILES for 3-methylpyrazolidin-1-amine is CC1CCN(N)N1.
What is the InChIKey of 3-methylpyrazolidin-1-amine?
The InChIKey is GBTFROWNOGYSJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3/c1-4-2-3-7(5)6-4/h4,6H,2-3,5H2,1H3.
What are the key properties of 3-methylpyrazolidin-1-amine?
3-methylpyrazolidin-1-amine has a molecular weight of 101.15 g/mol, XLogP of -0.54, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylpyrazolidin-1-amine is sourced from PubChem (CID 174846539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).