2-pyrrolidin-1-ylpropanehydrazide

C7H15N3O — CID 43906562

IUPAC2-pyrrolidin-1-ylpropanehydrazide
SMILESCC(C(=O)NN)N1CCCC1
InChIInChI=1S/C7H15N3O/c1-6(7(11)9-8)10-4-2-3-5-10/h6H,2-5,8H2,1H3,(H,9,11)
InChIKeyQDKJIJTVXUGOPA-UHFFFAOYSA-N
MW157.22 g/mol
LogP-0.54
Rot. Bonds2

About 2-pyrrolidin-1-ylpropanehydrazide

2-pyrrolidin-1-ylpropanehydrazide (PubChem CID 43906562) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 2-pyrrolidin-1-ylpropanehydrazide.

Molecular Properties

Compound Name2-pyrrolidin-1-ylpropanehydrazide
PubChem CID43906562
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name2-pyrrolidin-1-ylpropanehydrazide
SMILESCC(C(=O)NN)N1CCCC1
InChIInChI=1S/C7H15N3O/c1-6(7(11)9-8)10-4-2-3-5-10/h6H,2-5,8H2,1H3,(H,9,11)
InChIKeyQDKJIJTVXUGOPA-UHFFFAOYSA-N
XLogP-0.54
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-1-ylpropanehydrazide?
The IUPAC name of 2-pyrrolidin-1-ylpropanehydrazide (CID 43906562) is 2-pyrrolidin-1-ylpropanehydrazide.
What is the SMILES notation for 2-pyrrolidin-1-ylpropanehydrazide?
The canonical SMILES for 2-pyrrolidin-1-ylpropanehydrazide is CC(C(=O)NN)N1CCCC1.
What is the InChIKey of 2-pyrrolidin-1-ylpropanehydrazide?
The InChIKey is QDKJIJTVXUGOPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-6(7(11)9-8)10-4-2-3-5-10/h6H,2-5,8H2,1H3,(H,9,11).
What are the key properties of 2-pyrrolidin-1-ylpropanehydrazide?
2-pyrrolidin-1-ylpropanehydrazide has a molecular weight of 157.22 g/mol, XLogP of -0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-1-ylpropanehydrazide is sourced from PubChem (CID 43906562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).