2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide

C12H18N2O2 — CID 116846195

IUPAC2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide
SMILESCCc1cc(CC(=O)NNC)ccc1OC
InChIInChI=1S/C12H18N2O2/c1-4-10-7-9(5-6-11(10)16-3)8-12(15)14-13-2/h5-7,13H,4,8H2,1-3H3,(H,14,15)
InChIKeyWPDXGJQIVGOWAF-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.05
Rot. Bonds5

About 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide

2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide (PubChem CID 116846195) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide.

Molecular Properties

Compound Name2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide
PubChem CID116846195
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide
SMILESCCc1cc(CC(=O)NNC)ccc1OC
InChIInChI=1S/C12H18N2O2/c1-4-10-7-9(5-6-11(10)16-3)8-12(15)14-13-2/h5-7,13H,4,8H2,1-3H3,(H,14,15)
InChIKeyWPDXGJQIVGOWAF-UHFFFAOYSA-N
XLogP1.05
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(5-ethyl-2-methoxyphenyl)methoxy]-N'-methylacetohydrazide
CID 116846743
2-[[2-(3-ethyl-4-methoxyphenyl)acetyl]amino]propanoic acid
CID 112513636
2-(5-tert-butyl-2-methoxyphenyl)-N'-methylacetohydrazide
CID 116846169
2-(2-methoxyphenyl)-N'-methylacetohydrazide
CID 116846272
N-[2-(3-ethyl-4-methoxyphenyl)ethyl]propanamide
CID 110788746
N'-acetyl-2-(3,4-dimethoxyphenyl)acetohydrazide
CID 799227
(3-ethyl-4-methoxyphenyl)methanethiol
CID 82125341
4-[(3-ethyl-4-methoxyphenyl)methyl]-3,5-dimethylphenol
CID 66642899
N-[(5-ethyl-2-methoxyphenyl)methyl]-2-(methylamino)acetamide
CID 98784014
4-(3,4-dimethoxyphenyl)-N'-methylbutanehydrazide
CID 116846469
N'-[(3-ethyl-4-methoxyphenyl)methyl]oxamide
CID 115191824
2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide
CID 116846220

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide?
The IUPAC name of 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide (CID 116846195) is 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide.
What is the SMILES notation for 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide?
The canonical SMILES for 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide is CCc1cc(CC(=O)NNC)ccc1OC.
What is the InChIKey of 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide?
The InChIKey is WPDXGJQIVGOWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-4-10-7-9(5-6-11(10)16-3)8-12(15)14-13-2/h5-7,13H,4,8H2,1-3H3,(H,14,15).
What are the key properties of 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide?
2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide has a molecular weight of 222.29 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-4-methoxyphenyl)-N'-methylacetohydrazide is sourced from PubChem (CID 116846195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).