N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine

C10H14Cl2N2 — CID 83539537

IUPACN'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)c1ccc(Cl)cc1Cl
InChIInChI=1S/C10H14Cl2N2/c1-13-5-6-14(2)10-4-3-8(11)7-9(10)12/h3-4,7,13H,5-6H2,1-2H3
InChIKeyWSKHKNUOQCQFCG-UHFFFAOYSA-N
MW233.14 g/mol
LogP2.65
Rot. Bonds4

About N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine

N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine (PubChem CID 83539537) has the molecular formula C10H14Cl2N2 and a molecular weight of 233.14 g/mol. Its IUPAC name is N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine
PubChem CID83539537
Molecular FormulaC10H14Cl2N2
Molecular Weight233.14 g/mol
Exact Mass232.05
IUPAC NameN'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)c1ccc(Cl)cc1Cl
InChIInChI=1S/C10H14Cl2N2/c1-13-5-6-14(2)10-4-3-8(11)7-9(10)12/h3-4,7,13H,5-6H2,1-2H3
InChIKeyWSKHKNUOQCQFCG-UHFFFAOYSA-N
XLogP2.65
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.14
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine?
The IUPAC name of N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine (CID 83539537) is N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine?
The canonical SMILES for N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine is CNCCN(C)c1ccc(Cl)cc1Cl.
What is the InChIKey of N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine?
The InChIKey is WSKHKNUOQCQFCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N2/c1-13-5-6-14(2)10-4-3-8(11)7-9(10)12/h3-4,7,13H,5-6H2,1-2H3.
What are the key properties of N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine?
N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine has a molecular weight of 233.14 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,4-dichlorophenyl)-N,N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 83539537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).