2-(3,5-dichlorophenyl)-N,6-dimethylaniline

C14H13Cl2N — CID 170184256

IUPAC2-(3,5-dichlorophenyl)-N,6-dimethylaniline
SMILESCNc1c(C)cccc1-c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H13Cl2N/c1-9-4-3-5-13(14(9)17-2)10-6-11(15)8-12(16)7-10/h3-8,17H,1-2H3
InChIKeyPIWWPWNRMVJWHH-UHFFFAOYSA-N
MW266.17 g/mol
LogP5.01
Rot. Bonds2

About 2-(3,5-dichlorophenyl)-N,6-dimethylaniline

2-(3,5-dichlorophenyl)-N,6-dimethylaniline (PubChem CID 170184256) has the molecular formula C14H13Cl2N and a molecular weight of 266.17 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)-N,6-dimethylaniline.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)-N,6-dimethylaniline
PubChem CID170184256
Molecular FormulaC14H13Cl2N
Molecular Weight266.17 g/mol
Exact Mass265.04
IUPAC Name2-(3,5-dichlorophenyl)-N,6-dimethylaniline
SMILESCNc1c(C)cccc1-c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H13Cl2N/c1-9-4-3-5-13(14(9)17-2)10-6-11(15)8-12(16)7-10/h3-8,17H,1-2H3
InChIKeyPIWWPWNRMVJWHH-UHFFFAOYSA-N
XLogP5.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.17
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(3-chlorophenyl)-6-methylphenyl]formamide
CID 102337971
1-bromo-3-chloro-5-(2,3-dimethylphenyl)benzene
CID 164892523
2-fluoro-N,6-dimethylaniline;hydrochloride
CID 167737520
N-methyl-2,6-diphenylaniline
CID 123873033
3-(3,5-dichlorophenyl)-2-methylpyridine
CID 90167646
1-(3,5-dichlorophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991412
1-(3,5-dichlorophenyl)triphenylene
CID 156653515
2-(3,5-dichlorophenyl)-6-fluoro-N,N-dimethylaniline
CID 134631655
N-(4-chloro-2-methylphenyl)-2,6-dimethylaniline
CID 57056849
N-(4-chlorophenyl)-2,6-dimethylaniline
CID 10977319
2,6-dichloro-4-(2-fluoro-3-methylphenyl)pyridine
CID 125484786
1-(3,5-dichlorophenyl)-9,9'-spirobi[fluorene]
CID 156896575

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)-N,6-dimethylaniline?
The IUPAC name of 2-(3,5-dichlorophenyl)-N,6-dimethylaniline (CID 170184256) is 2-(3,5-dichlorophenyl)-N,6-dimethylaniline.
What is the SMILES notation for 2-(3,5-dichlorophenyl)-N,6-dimethylaniline?
The canonical SMILES for 2-(3,5-dichlorophenyl)-N,6-dimethylaniline is CNc1c(C)cccc1-c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenyl)-N,6-dimethylaniline?
The InChIKey is PIWWPWNRMVJWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2N/c1-9-4-3-5-13(14(9)17-2)10-6-11(15)8-12(16)7-10/h3-8,17H,1-2H3.
What are the key properties of 2-(3,5-dichlorophenyl)-N,6-dimethylaniline?
2-(3,5-dichlorophenyl)-N,6-dimethylaniline has a molecular weight of 266.17 g/mol, XLogP of 5.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)-N,6-dimethylaniline is sourced from PubChem (CID 170184256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).