2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride

C10H13Cl3N2O — CID 45264353

IUPAC2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride
SMILESC/N=C(/COc1ccc(Cl)cc1Cl)NC.Cl
InChIInChI=1S/C10H12Cl2N2O.ClH/c1-13-10(14-2)6-15-9-4-3-7(11)5-8(9)12;/h3-5H,6H2,1-2H3,(H,13,14);1H
InChIKeyUQZTWPSBKOSPQP-UHFFFAOYSA-N
MW283.59 g/mol
LogP3.04
Rot. Bonds3

About 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride

2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride (PubChem CID 45264353) has the molecular formula C10H13Cl3N2O and a molecular weight of 283.59 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride
PubChem CID45264353
Molecular FormulaC10H13Cl3N2O
Molecular Weight283.59 g/mol
Exact Mass282.01
IUPAC Name2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride
SMILESC/N=C(/COc1ccc(Cl)cc1Cl)NC.Cl
InChIInChI=1S/C10H12Cl2N2O.ClH/c1-13-10(14-2)6-15-9-4-3-7(11)5-8(9)12;/h3-5H,6H2,1-2H3,(H,13,14);1H
InChIKeyUQZTWPSBKOSPQP-UHFFFAOYSA-N
XLogP3.04
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.59
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

sodium;2-(2,4-dichlorophenoxy)acetic acid;hydride;N-methylmethanamine
CID 173432017
sodium 2-(2,4-dichlorophenoxy)acetic acid
CID 91996937
tris(2-(2,4-dichlorophenoxy)acetic acid);samarium
CID 164580360
N-(2,4-dichlorophenoxy)methanamine
CID 174617180
disodium bis(2-(2,4-dichlorophenoxy)acetate)
CID 66727836
calcium;2-(2,4-dichlorophenoxy)acetic acid;hydride
CID 173483555
N'-[[1-amino-2-(2,4-dichlorophenoxy)ethylidene]amino]oxamide
CID 3799613
ethyl 2-(2,4-dichlorophenoxy)acetate
CID 10780
potassium 2-(2,4-dichlorophenoxy)-N-oxidoacetamide
CID 23697377
2-[(2,4-dichlorophenoxy)methyl]prop-2-ene-1-thiol
CID 103073637
deuterio 2-(2,4-dichlorophenoxy)acetate
CID 138395985
2-[[2-(2,4-dichlorophenoxy)acetyl]-[(2,4-dichlorophenyl)methyl]amino]-N-methylpropanamide
CID 132676547

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride (CID 45264353) is 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride is C/N=C(/COc1ccc(Cl)cc1Cl)NC.Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride?
The InChIKey is UQZTWPSBKOSPQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2O.ClH/c1-13-10(14-2)6-15-9-4-3-7(11)5-8(9)12;/h3-5H,6H2,1-2H3,(H,13,14);1H.
What are the key properties of 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride?
2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride has a molecular weight of 283.59 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N,N'-dimethylethanimidamide;hydrochloride is sourced from PubChem (CID 45264353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).