3-(4,5-dihydroimidazol-1-yl)propanehydrazide

C6H12N4O — CID 23136083

IUPAC3-(4,5-dihydroimidazol-1-yl)propanehydrazide
SMILESNNC(=O)CCN1C=NCC1
InChIInChI=1S/C6H12N4O/c7-9-6(11)1-3-10-4-2-8-5-10/h5H,1-4,7H2,(H,9,11)
InChIKeyAHWNWMHIGYBFQS-UHFFFAOYSA-N
MW156.19 g/mol
LogP-1.29
Rot. Bonds3

About 3-(4,5-dihydroimidazol-1-yl)propanehydrazide

3-(4,5-dihydroimidazol-1-yl)propanehydrazide (PubChem CID 23136083) has the molecular formula C6H12N4O and a molecular weight of 156.19 g/mol. Its IUPAC name is 3-(4,5-dihydroimidazol-1-yl)propanehydrazide.

Molecular Properties

Compound Name3-(4,5-dihydroimidazol-1-yl)propanehydrazide
PubChem CID23136083
Molecular FormulaC6H12N4O
Molecular Weight156.19 g/mol
Exact Mass156.10
IUPAC Name3-(4,5-dihydroimidazol-1-yl)propanehydrazide
SMILESNNC(=O)CCN1C=NCC1
InChIInChI=1S/C6H12N4O/c7-9-6(11)1-3-10-4-2-8-5-10/h5H,1-4,7H2,(H,9,11)
InChIKeyAHWNWMHIGYBFQS-UHFFFAOYSA-N
XLogP-1.29
TPSA70.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-1.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'}

Analyze 3-(4,5-dihydroimidazol-1-yl)propanehydrazide 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 3-(4,5-dihydroimidazol-1-yl)propanehydrazide?
The IUPAC name of 3-(4,5-dihydroimidazol-1-yl)propanehydrazide (CID 23136083) is 3-(4,5-dihydroimidazol-1-yl)propanehydrazide.
What is the SMILES notation for 3-(4,5-dihydroimidazol-1-yl)propanehydrazide?
The canonical SMILES for 3-(4,5-dihydroimidazol-1-yl)propanehydrazide is NNC(=O)CCN1C=NCC1.
What is the InChIKey of 3-(4,5-dihydroimidazol-1-yl)propanehydrazide?
The InChIKey is AHWNWMHIGYBFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O/c7-9-6(11)1-3-10-4-2-8-5-10/h5H,1-4,7H2,(H,9,11).
What are the key properties of 3-(4,5-dihydroimidazol-1-yl)propanehydrazide?
3-(4,5-dihydroimidazol-1-yl)propanehydrazide has a molecular weight of 156.19 g/mol, XLogP of -1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-dihydroimidazol-1-yl)propanehydrazide is sourced from PubChem (CID 23136083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).