2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline

C16H18Cl2N2 — CID 68796254

IUPAC2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline
SMILESCN(C)CCc1ccccc1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C16H18Cl2N2/c1-20(2)11-10-12-6-3-4-9-15(12)19-16-13(17)7-5-8-14(16)18/h3-9,19H,10-11H2,1-2H3
InChIKeyUNIWUUKLCHOXJB-UHFFFAOYSA-N
MW309.24 g/mol
LogP4.84
Rot. Bonds5

About 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline

2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline (PubChem CID 68796254) has the molecular formula C16H18Cl2N2 and a molecular weight of 309.24 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline.

Molecular Properties

Compound Name2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline
PubChem CID68796254
Molecular FormulaC16H18Cl2N2
Molecular Weight309.24 g/mol
Exact Mass308.08
IUPAC Name2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline
SMILESCN(C)CCc1ccccc1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C16H18Cl2N2/c1-20(2)11-10-12-6-3-4-9-15(12)19-16-13(17)7-5-8-14(16)18/h3-9,19H,10-11H2,1-2H3
InChIKeyUNIWUUKLCHOXJB-UHFFFAOYSA-N
XLogP4.84
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.24
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine
CID 57171134
2-[2-(2,6-dichloroanilino)phenyl]acetic acid;hydrate
CID 68653725
strontium;2-[2-(2,6-dichloroanilino)phenyl]acetic acid;hydride
CID 173032882
2,2-dideuterio-2-[2-(2,6-dichloroanilino)phenyl]acetic acid
CID 10661763
2-[2-(2,6-dichloroanilino)phenyl]ethanone;oxosilver
CID 171593274
4-[2-[2-(dimethylamino)ethyl]anilino]benzoic acid
CID 18783963
[2-(2,6-dichloroanilino)phenyl]methyl formate
CID 88975698
1-aminoethanol;2-[2-(2,6-dichloroanilino)phenyl]acetic acid;hydrochloride
CID 86623054
2-[2-[2-[2-(2,6-dichloroanilino)phenyl]acetyl]oxyethoxy]ethyl 2-[2-(2,6-dichloroanilino)phenyl]acetate
CID 59981465
tert-butyl N-[4-(2-chloroanilino)-3-[2-(dimethylamino)ethyl]phenyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
CID 156868548
2-[2-(2,6-dichloroanilino)phenyl]acetate;tris(hydroxymethyl)-methylazanium
CID 15917937
(2-methoxy-2-oxoethyl) 2-[2-(2,6-dichloroanilino)phenyl]acetate
CID 46783545

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline?
The IUPAC name of 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline (CID 68796254) is 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline.
What is the SMILES notation for 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline?
The canonical SMILES for 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline is CN(C)CCc1ccccc1Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline?
The InChIKey is UNIWUUKLCHOXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Cl2N2/c1-20(2)11-10-12-6-3-4-9-15(12)19-16-13(17)7-5-8-14(16)18/h3-9,19H,10-11H2,1-2H3.
What are the key properties of 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline?
2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline has a molecular weight of 309.24 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline is sourced from PubChem (CID 68796254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).