3-(4-ethoxyphenyl)-N'-methylpropanehydrazide

C12H18N2O2 — CID 116846343

IUPAC3-(4-ethoxyphenyl)-N'-methylpropanehydrazide
SMILESCCOc1ccc(CCC(=O)NNC)cc1
InChIInChI=1S/C12H18N2O2/c1-3-16-11-7-4-10(5-8-11)6-9-12(15)14-13-2/h4-5,7-8,13H,3,6,9H2,1-2H3,(H,14,15)
InChIKeyCINPLZXVGMMBJD-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.27
Rot. Bonds6

About 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide

3-(4-ethoxyphenyl)-N'-methylpropanehydrazide (PubChem CID 116846343) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide.

Molecular Properties

Compound Name3-(4-ethoxyphenyl)-N'-methylpropanehydrazide
PubChem CID116846343
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name3-(4-ethoxyphenyl)-N'-methylpropanehydrazide
SMILESCCOc1ccc(CCC(=O)NNC)cc1
InChIInChI=1S/C12H18N2O2/c1-3-16-11-7-4-10(5-8-11)6-9-12(15)14-13-2/h4-5,7-8,13H,3,6,9H2,1-2H3,(H,14,15)
InChIKeyCINPLZXVGMMBJD-UHFFFAOYSA-N
XLogP1.27
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide 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-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide
CID 116846735
3-(4-ethoxyphenyl)-N',N'-dimethylpropanehydrazide
CID 116847579
N-[2-(4-ethoxyphenyl)ethyl]-3-(4-hydroxyphenyl)propanamide
CID 174483925
N-(2-aminopropyl)-3-(4-ethoxyphenyl)propanamide
CID 110833167
1-(4-ethoxyphenyl)hexan-3-one
CID 64505470
3-(4-ethoxyphenyl)propanamide;hydrochloride
CID 172679140
4-(4-ethoxyphenyl)-2-oxobutanoic acid
CID 82185773
methyl 2-[3-(4-ethoxyphenyl)propanoylamino]benzoate
CID 19225981
N'-methyl-3-(4-phenylphenyl)propanehydrazide
CID 116846347
3-(4-ethoxyphenyl)-N-(4-propan-2-ylphenyl)propanamide
CID 19225956
N-[4-(diethylamino)phenyl]-3-(4-ethoxyphenyl)propanamide
CID 19226078
4-(4-ethoxyphenyl)-1,1,1-trifluorobutan-2-one
CID 59202399

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide?
The IUPAC name of 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide (CID 116846343) is 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide.
What is the SMILES notation for 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide?
The canonical SMILES for 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide is CCOc1ccc(CCC(=O)NNC)cc1.
What is the InChIKey of 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide?
The InChIKey is CINPLZXVGMMBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-3-16-11-7-4-10(5-8-11)6-9-12(15)14-13-2/h4-5,7-8,13H,3,6,9H2,1-2H3,(H,14,15).
What are the key properties of 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide?
3-(4-ethoxyphenyl)-N'-methylpropanehydrazide has a molecular weight of 222.29 g/mol, XLogP of 1.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenyl)-N'-methylpropanehydrazide is sourced from PubChem (CID 116846343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).