pyrazolidine-1-carboxamide

C4H9N3O — CID 18386779

IUPACpyrazolidine-1-carboxamide
SMILESNC(=O)N1CCCN1
InChIInChI=1S/C4H9N3O/c5-4(8)7-3-1-2-6-7/h6H,1-3H2,(H2,5,8)
InChIKeyLXWHOYSOMNNXRS-UHFFFAOYSA-N
MW115.14 g/mol
LogP-0.72
Rot. Bonds

About pyrazolidine-1-carboxamide

pyrazolidine-1-carboxamide (PubChem CID 18386779) has the molecular formula C4H9N3O and a molecular weight of 115.14 g/mol. Its IUPAC name is pyrazolidine-1-carboxamide.

Molecular Properties

Compound Namepyrazolidine-1-carboxamide
PubChem CID18386779
Molecular FormulaC4H9N3O
Molecular Weight115.14 g/mol
Exact Mass115.07
IUPAC Namepyrazolidine-1-carboxamide
SMILESNC(=O)N1CCCN1
InChIInChI=1S/C4H9N3O/c5-4(8)7-3-1-2-6-7/h6H,1-3H2,(H2,5,8)
InChIKeyLXWHOYSOMNNXRS-UHFFFAOYSA-N
XLogP-0.72
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.14
LogP ≤ 5-0.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze pyrazolidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of pyrazolidine-1-carboxamide?
The IUPAC name of pyrazolidine-1-carboxamide (CID 18386779) is pyrazolidine-1-carboxamide.
What is the SMILES notation for pyrazolidine-1-carboxamide?
The canonical SMILES for pyrazolidine-1-carboxamide is NC(=O)N1CCCN1.
What is the InChIKey of pyrazolidine-1-carboxamide?
The InChIKey is LXWHOYSOMNNXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N3O/c5-4(8)7-3-1-2-6-7/h6H,1-3H2,(H2,5,8).
What are the key properties of pyrazolidine-1-carboxamide?
pyrazolidine-1-carboxamide has a molecular weight of 115.14 g/mol, XLogP of -0.72, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazolidine-1-carboxamide is sourced from PubChem (CID 18386779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).