2,6-dichloro-N-(2-propan-2-ylphenyl)aniline

C15H15Cl2N — CID 10934820

IUPAC2,6-dichloro-N-(2-propan-2-ylphenyl)aniline
SMILESCC(C)c1ccccc1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C15H15Cl2N/c1-10(2)11-6-3-4-9-14(11)18-15-12(16)7-5-8-13(15)17/h3-10,18H,1-2H3
InChIKeyQOVRGUCMXQGRIJ-UHFFFAOYSA-N
MW280.20 g/mol
LogP5.86
Rot. Bonds3

About 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline

2,6-dichloro-N-(2-propan-2-ylphenyl)aniline (PubChem CID 10934820) has the molecular formula C15H15Cl2N and a molecular weight of 280.20 g/mol. Its IUPAC name is 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline.

Molecular Properties

Compound Name2,6-dichloro-N-(2-propan-2-ylphenyl)aniline
PubChem CID10934820
Molecular FormulaC15H15Cl2N
Molecular Weight280.20 g/mol
Exact Mass279.06
IUPAC Name2,6-dichloro-N-(2-propan-2-ylphenyl)aniline
SMILESCC(C)c1ccccc1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C15H15Cl2N/c1-10(2)11-6-3-4-9-14(11)18-15-12(16)7-5-8-13(15)17/h3-10,18H,1-2H3
InChIKeyQOVRGUCMXQGRIJ-UHFFFAOYSA-N
XLogP5.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.20
LogP ≤ 55.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-Chloroiminodibenzyl
CID 118364
2,6-Dichloro-N-phenylaniline
CID 84867
(3,5-Dichloro-Phenyl)-(2,4,6-Trimethyl-Phenyl)-Amine
CID 71562077
(2,5-Dichlorophenyl)-(2,4,6-trimethylphenyl)-amine
CID 71562078
2-{2-[(2,6-Dichlorophenyl)amino]phenyl}propanamide
CID 45269050
N-(tert-Butyl)-2-{2-[(2,6-dichlorophenyl)amino]phenyl}propanamide
CID 45269895
N-(2,4-dichloro-6-methylphenyl)-2,4,6-trimethylaniline
CID 127044578
2,6-dichloro-N-(2-ethylphenyl)aniline
CID 11076363
2,6-dichloro-N-(2-propylphenyl)aniline
CID 11108716
2,6-dichloro-N-(o-tolyl)aniline
CID 19002392
Benzenamine, 4-chloro-2-methyl-N-(2-methylphenyl)-
CID 3049247
2,6-dichloro-N-[2-(2-chloroethyl)phenyl]aniline
CID 10902675

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline?
The IUPAC name of 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline (CID 10934820) is 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline.
What is the SMILES notation for 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline?
The canonical SMILES for 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline is CC(C)c1ccccc1Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline?
The InChIKey is QOVRGUCMXQGRIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2N/c1-10(2)11-6-3-4-9-14(11)18-15-12(16)7-5-8-13(15)17/h3-10,18H,1-2H3.
What are the key properties of 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline?
2,6-dichloro-N-(2-propan-2-ylphenyl)aniline has a molecular weight of 280.20 g/mol, XLogP of 5.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(2-propan-2-ylphenyl)aniline is sourced from PubChem (CID 10934820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).