1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine

C13H20N2O2 — CID 75095312

IUPAC1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine
SMILESCCCOc1ccc(C(C)=NN)cc1OCC
InChIInChI=1S/C13H20N2O2/c1-4-8-17-12-7-6-11(10(3)15-14)9-13(12)16-5-2/h6-7,9H,4-5,8,14H2,1-3H3
InChIKeyWCJQBXTXRZGQDR-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.56
Rot. Bonds6

About 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine

1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine (PubChem CID 75095312) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine.

Molecular Properties

Compound Name1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine
PubChem CID75095312
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine
SMILESCCCOc1ccc(C(C)=NN)cc1OCC
InChIInChI=1S/C13H20N2O2/c1-4-8-17-12-7-6-11(10(3)15-14)9-13(12)16-5-2/h6-7,9H,4-5,8,14H2,1-3H3
InChIKeyWCJQBXTXRZGQDR-UHFFFAOYSA-N
XLogP2.56
TPSA56.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.56
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 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine 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

2-[1-(3,4-dipropoxyphenyl)ethylideneamino]guanidine
CID 76872420
[(2S)-1-amino-1-oxopropan-2-yl] 3-ethoxy-4-propoxybenzoate
CID 2667445
N-(2-aminoethyl)-3-ethoxy-4-propoxybenzamide
CID 119384376
3-ethoxy-N',N'-dimethyl-4-propoxybenzohydrazide
CID 9164038
N-[(2S)-1-aminopropan-2-yl]-3-ethoxy-4-propoxybenzamide
CID 120504957
ethyl 4-(2-methoxyethoxy)-3-propoxybenzoate
CID 121423908
N-(3-aminobutyl)-3-ethoxy-4-propoxybenzamide
CID 119498085
N-(3-acetamidophenyl)-3-ethoxy-4-propoxybenzamide
CID 26103323
2-amino-1-(3,4-diethoxyphenyl)ethanone;hydrochloride
CID 131632754
2-amino-3-(3-ethoxy-4-propoxyphenyl)propanoic acid
CID 170879715
1-(3,4-dipropoxyphenyl)-3-hydroxyprop-2-en-1-one
CID 28896001
1-(4-butoxy-3-ethoxyphenyl)propan-1-one
CID 83952161

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine?
The IUPAC name of 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine (CID 75095312) is 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine.
What is the SMILES notation for 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine?
The canonical SMILES for 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine is CCCOc1ccc(C(C)=NN)cc1OCC.
What is the InChIKey of 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine?
The InChIKey is WCJQBXTXRZGQDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-8-17-12-7-6-11(10(3)15-14)9-13(12)16-5-2/h6-7,9H,4-5,8,14H2,1-3H3.
What are the key properties of 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine?
1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine has a molecular weight of 236.31 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxy-4-propoxyphenyl)ethylidenehydrazine is sourced from PubChem (CID 75095312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).