2-hydrazinylideneethyl propanoate

C5H10N2O2 — CID 174347476

IUPAC2-hydrazinylideneethyl propanoate
SMILESCCC(=O)OCC=NN
InChIInChI=1S/C5H10N2O2/c1-2-5(8)9-4-3-7-6/h3H,2,4,6H2,1H3
InChIKeyOQRXTLCPRHDVNL-UHFFFAOYSA-N
MW130.15 g/mol
LogP-0.12
Rot. Bonds3

About 2-hydrazinylideneethyl propanoate

2-hydrazinylideneethyl propanoate (PubChem CID 174347476) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is 2-hydrazinylideneethyl propanoate.

Molecular Properties

Compound Name2-hydrazinylideneethyl propanoate
PubChem CID174347476
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name2-hydrazinylideneethyl propanoate
SMILESCCC(=O)OCC=NN
InChIInChI=1S/C5H10N2O2/c1-2-5(8)9-4-3-7-6/h3H,2,4,6H2,1H3
InChIKeyOQRXTLCPRHDVNL-UHFFFAOYSA-N
XLogP-0.12
TPSA64.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-hydrazinylideneethyl propanoate with MolForge

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

Launch Full Analysis

Related Compounds

azane;prop-2-enyl propanoate
CID 87729437
propan-2-one;prop-2-enyl propanoate
CID 174904905
chloromethane;prop-2-enyl propanoate
CID 174815872
penta-2,4-dienyl propanoate
CID 54073728
ethyl propanoate;methane
CID 161360642
alumane;ethyl propanoate
CID 174257559
[(2E,4E)-4-methylhexa-2,4-dienyl] propanoate
CID 15624868
[(Z)-3-methyl-5-propanoyloxypent-3-enyl] propanoate
CID 146216389
ethyl propanoate;titanium(4+);tetrachloride
CID 173205872
calcium;ethyl propanoate;hydride
CID 173132885
silylmethyl propanoate
CID 152513576
ethyl propanoate;tin(2+);dichloride
CID 171374953

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinylideneethyl propanoate?
The IUPAC name of 2-hydrazinylideneethyl propanoate (CID 174347476) is 2-hydrazinylideneethyl propanoate.
What is the SMILES notation for 2-hydrazinylideneethyl propanoate?
The canonical SMILES for 2-hydrazinylideneethyl propanoate is CCC(=O)OCC=NN.
What is the InChIKey of 2-hydrazinylideneethyl propanoate?
The InChIKey is OQRXTLCPRHDVNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-2-5(8)9-4-3-7-6/h3H,2,4,6H2,1H3.
What are the key properties of 2-hydrazinylideneethyl propanoate?
2-hydrazinylideneethyl propanoate has a molecular weight of 130.15 g/mol, XLogP of -0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinylideneethyl propanoate is sourced from PubChem (CID 174347476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).