N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide

C12H18N2O2 — CID 116847839

IUPACN',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide
SMILESCc1ccc(COCC(=O)NN(C)C)cc1
InChIInChI=1S/C12H18N2O2/c1-10-4-6-11(7-5-10)8-16-9-12(15)13-14(2)3/h4-7H,8-9H2,1-3H3,(H,13,15)
InChIKeyCDBPQXFVHZCQTD-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.10
Rot. Bonds5

About N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide

N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide (PubChem CID 116847839) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide.

Molecular Properties

Compound NameN',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide
PubChem CID116847839
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide
SMILESCc1ccc(COCC(=O)NN(C)C)cc1
InChIInChI=1S/C12H18N2O2/c1-10-4-6-11(7-5-10)8-16-9-12(15)13-14(2)3/h4-7H,8-9H2,1-3H3,(H,13,15)
InChIKeyCDBPQXFVHZCQTD-UHFFFAOYSA-N
XLogP1.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.10
H-Bond Donors ≤ 51
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-[(2,5-dimethylphenyl)methoxy]-N',N'-dimethylacetohydrazide
CID 116847844
2-[(4-ethoxy-3-methylphenyl)methoxy]-N',N'-dimethylacetohydrazide
CID 116847879
2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide
CID 116847913
1-bromo-3-[(4-methylphenyl)methoxy]propan-2-one
CID 170561700
1-methyl-4-(2-methylprop-2-enoxymethyl)benzene
CID 10702431
2-(1-benzofuran-3-ylmethoxy)-N',N'-dimethylacetohydrazide
CID 116847923
2-[(4-tert-butylphenyl)methoxy]-N'-methylacetohydrazide
CID 116846699
methyl 4-bromo-2-[2-[(4-methylphenyl)methoxy]acetyl]benzoate
CID 166874391
N-methyl-4-(4-methylphenoxy)butanamide;N-methyl-2-[2-(4-methylphenyl)ethoxy]acetamide;N-methyl-2-[(4-methylphenyl)methoxy]acetamide
CID 159463012
N',N'-dimethyl-3-(6-methylnaphthalen-2-yl)propanehydrazide
CID 116847656
2-[(3,4-dimethylphenyl)methoxy]-N'-methylacetohydrazide
CID 116846700
N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide
CID 116846698

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide?
The IUPAC name of N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide (CID 116847839) is N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide.
What is the SMILES notation for N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide?
The canonical SMILES for N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide is Cc1ccc(COCC(=O)NN(C)C)cc1.
What is the InChIKey of N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide?
The InChIKey is CDBPQXFVHZCQTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-10-4-6-11(7-5-10)8-16-9-12(15)13-14(2)3/h4-7H,8-9H2,1-3H3,(H,13,15).
What are the key properties of N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide?
N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide has a molecular weight of 222.29 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-2-[(4-methylphenyl)methoxy]acetohydrazide is sourced from PubChem (CID 116847839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).