3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide

C10H12Cl2N2O2 — CID 116820473

IUPAC3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide
SMILESCN(N)C(=O)CCOc1ccc(Cl)cc1Cl
InChIInChI=1S/C10H12Cl2N2O2/c1-14(13)10(15)4-5-16-9-3-2-7(11)6-8(9)12/h2-3,6H,4-5,13H2,1H3
InChIKeyKWAJZOGOUAXIKT-UHFFFAOYSA-N
MW263.12 g/mol
LogP2.09
Rot. Bonds4

About 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide

3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide (PubChem CID 116820473) has the molecular formula C10H12Cl2N2O2 and a molecular weight of 263.12 g/mol. Its IUPAC name is 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide.

Molecular Properties

Compound Name3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide
PubChem CID116820473
Molecular FormulaC10H12Cl2N2O2
Molecular Weight263.12 g/mol
Exact Mass262.03
IUPAC Name3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide
SMILESCN(N)C(=O)CCOc1ccc(Cl)cc1Cl
InChIInChI=1S/C10H12Cl2N2O2/c1-14(13)10(15)4-5-16-9-3-2-7(11)6-8(9)12/h2-3,6H,4-5,13H2,1H3
InChIKeyKWAJZOGOUAXIKT-UHFFFAOYSA-N
XLogP2.09
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.12
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethyl 3-[2-(2,4-dichlorophenoxy)ethyl-methylamino]propanoate
CID 62012022
N-(3-amino-2,2-dimethylpropyl)-3-(2,4-dichlorophenoxy)-N-methylpropanamide;hydrochloride
CID 119655726
3-(4-amino-2-chlorophenoxy)-N,N-dimethylpropanamide
CID 47002615
ethyl 2-(2,4-dichlorophenoxy)acetate
CID 10780
4-(2,4-dichlorophenoxy)-N-ethoxybutanamide
CID 52540404
3-(2,4-dichlorophenoxy)-N,N-dimethylpropan-1-amine
CID 5262075
N,N-di(butan-2-yl)-4-(2,4-dichlorophenoxy)butanamide
CID 4181980
2-(2,4-dichlorophenyl)-N-methylacetohydrazide
CID 116844869
N-(3-aminobutyl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride
CID 119498285
4-(2,4-dichlorophenoxy)-N-ethyl-N-propylbutanamide
CID 162432622
N'-[2-(2,4-dichlorophenoxy)ethyl]-N'-methylethane-1,2-diamine
CID 62688620
2-(3-chloro-4-ethoxyphenyl)-N-methylacetohydrazide
CID 116844806

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide?
The IUPAC name of 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide (CID 116820473) is 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide.
What is the SMILES notation for 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide?
The canonical SMILES for 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide is CN(N)C(=O)CCOc1ccc(Cl)cc1Cl.
What is the InChIKey of 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide?
The InChIKey is KWAJZOGOUAXIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2O2/c1-14(13)10(15)4-5-16-9-3-2-7(11)6-8(9)12/h2-3,6H,4-5,13H2,1H3.
What are the key properties of 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide?
3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide has a molecular weight of 263.12 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenoxy)-N-methylpropanehydrazide is sourced from PubChem (CID 116820473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).