2-(2-oxopyrrolidin-1-yl)propanehydrazide

C7H13N3O2 — CID 13150926

IUPAC2-(2-oxopyrrolidin-1-yl)propanehydrazide
SMILESCC(C(=O)NN)N1CCCC1=O
InChIInChI=1S/C7H13N3O2/c1-5(7(12)9-8)10-4-2-3-6(10)11/h5H,2-4,8H2,1H3,(H,9,12)
InChIKeyLHYKLTWIIBSYNX-UHFFFAOYSA-N
MW171.20 g/mol
LogP-1.01
Rot. Bonds2

About 2-(2-oxopyrrolidin-1-yl)propanehydrazide

2-(2-oxopyrrolidin-1-yl)propanehydrazide (PubChem CID 13150926) has the molecular formula C7H13N3O2 and a molecular weight of 171.20 g/mol. Its IUPAC name is 2-(2-oxopyrrolidin-1-yl)propanehydrazide.

Molecular Properties

Compound Name2-(2-oxopyrrolidin-1-yl)propanehydrazide
PubChem CID13150926
Molecular FormulaC7H13N3O2
Molecular Weight171.20 g/mol
Exact Mass171.10
IUPAC Name2-(2-oxopyrrolidin-1-yl)propanehydrazide
SMILESCC(C(=O)NN)N1CCCC1=O
InChIInChI=1S/C7H13N3O2/c1-5(7(12)9-8)10-4-2-3-6(10)11/h5H,2-4,8H2,1H3,(H,9,12)
InChIKeyLHYKLTWIIBSYNX-UHFFFAOYSA-N
XLogP-1.01
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-1.01
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-(2-oxopyrrolidin-1-yl)propanehydrazide?
The IUPAC name of 2-(2-oxopyrrolidin-1-yl)propanehydrazide (CID 13150926) is 2-(2-oxopyrrolidin-1-yl)propanehydrazide.
What is the SMILES notation for 2-(2-oxopyrrolidin-1-yl)propanehydrazide?
The canonical SMILES for 2-(2-oxopyrrolidin-1-yl)propanehydrazide is CC(C(=O)NN)N1CCCC1=O.
What is the InChIKey of 2-(2-oxopyrrolidin-1-yl)propanehydrazide?
The InChIKey is LHYKLTWIIBSYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2/c1-5(7(12)9-8)10-4-2-3-6(10)11/h5H,2-4,8H2,1H3,(H,9,12).
What are the key properties of 2-(2-oxopyrrolidin-1-yl)propanehydrazide?
2-(2-oxopyrrolidin-1-yl)propanehydrazide has a molecular weight of 171.20 g/mol, XLogP of -1.01, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxopyrrolidin-1-yl)propanehydrazide is sourced from PubChem (CID 13150926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).