2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide

C12H18N2O3 — CID 116846220

IUPAC2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide
SMILESCNNC(=O)Cc1ccc(OC)c(C)c1OC
InChIInChI=1S/C12H18N2O3/c1-8-10(16-3)6-5-9(12(8)17-4)7-11(15)14-13-2/h5-6,13H,7H2,1-4H3,(H,14,15)
InChIKeyDNRKYLWMHWBZMT-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.81
Rot. Bonds5

About 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide

2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide (PubChem CID 116846220) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide.

Molecular Properties

Compound Name2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide
PubChem CID116846220
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide
SMILESCNNC(=O)Cc1ccc(OC)c(C)c1OC
InChIInChI=1S/C12H18N2O3/c1-8-10(16-3)6-5-9(12(8)17-4)7-11(15)14-13-2/h5-6,13H,7H2,1-4H3,(H,14,15)
InChIKeyDNRKYLWMHWBZMT-UHFFFAOYSA-N
XLogP0.81
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[(2,4-dimethoxy-3-methylphenyl)methylamino]propan-2-one
CID 115234740
1-ethyl-2,4-dimethoxy-3-methylbenzene
CID 524865
N-[(2,4-dimethoxy-3-methylphenyl)methyl]-2-(2-methylphenyl)acetamide
CID 110783236
2-cyano-N-[(2,4-dimethoxy-3-methylphenyl)methyl]acetamide
CID 115173101
2-(2-methoxyphenyl)-N'-methylacetohydrazide
CID 116846272
2-(2,4-dimethoxy-3-methylphenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110769878
2-(2,4-dimethoxy-3-methylphenyl)-N-(2-phenylethyl)acetamide
CID 110769821
3-(2,4-dimethoxy-3-methylphenyl)-2-(methylamino)propanoic acid
CID 116932022
3-amino-N-[(2,4-dimethoxy-3-methylphenyl)methyl]butanamide
CID 115154202
N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide
CID 110783214
2-(2,4-dimethoxy-3-methylphenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 110769817
N'-[(2,4-dimethoxy-3-methylphenyl)methyl]-N-methylmethanediamine
CID 115226861

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide?
The IUPAC name of 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide (CID 116846220) is 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide.
What is the SMILES notation for 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide?
The canonical SMILES for 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide is CNNC(=O)Cc1ccc(OC)c(C)c1OC.
What is the InChIKey of 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide?
The InChIKey is DNRKYLWMHWBZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-8-10(16-3)6-5-9(12(8)17-4)7-11(15)14-13-2/h5-6,13H,7H2,1-4H3,(H,14,15).
What are the key properties of 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide?
2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide has a molecular weight of 238.29 g/mol, XLogP of 0.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide is sourced from PubChem (CID 116846220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).