3,4-dichloro-N-ethyl-N-methylaniline

C9H11Cl2N — CID 59726249

IUPAC3,4-dichloro-N-ethyl-N-methylaniline
SMILESCCN(C)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C9H11Cl2N/c1-3-12(2)7-4-5-8(10)9(11)6-7/h4-6H,3H2,1-2H3
InChIKeyHTGBUVNUQKWOLA-UHFFFAOYSA-N
MW204.10 g/mol
LogP3.45
Rot. Bonds2

About 3,4-dichloro-N-ethyl-N-methylaniline

3,4-dichloro-N-ethyl-N-methylaniline (PubChem CID 59726249) has the molecular formula C9H11Cl2N and a molecular weight of 204.10 g/mol. Its IUPAC name is 3,4-dichloro-N-ethyl-N-methylaniline.

Molecular Properties

Compound Name3,4-dichloro-N-ethyl-N-methylaniline
PubChem CID59726249
Molecular FormulaC9H11Cl2N
Molecular Weight204.10 g/mol
Exact Mass203.03
IUPAC Name3,4-dichloro-N-ethyl-N-methylaniline
SMILESCCN(C)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C9H11Cl2N/c1-3-12(2)7-4-5-8(10)9(11)6-7/h4-6H,3H2,1-2H3
InChIKeyHTGBUVNUQKWOLA-UHFFFAOYSA-N
XLogP3.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.10
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3,4-dichlorophenyl)-N',N'-diethyl-N-methylethane-1,2-diamine
CID 23317090
N'-(3,4-dichlorophenyl)-N'-methylpropane-1,3-diamine
CID 28772810
3-(3,4-dichloro-N-methylanilino)propan-1-ol
CID 82116339
3-(3,4-dichloro-N-methylanilino)-2-methylpropanenitrile
CID 82117804
3,4-dichloro-N-methyl-N-phenylaniline
CID 73012191
N-ethyl-N,4-dimethylaniline
CID 3036494
2-N,7-N-diethyl-2-N,7-N-dimethylphenanthrene-2,7-diamine;ethane;methane
CID 160718601
(4E)-1-(3,4-dichlorophenyl)-4-[[4-[ethyl(methyl)amino]phenyl]methylidene]pyrazolidine-3,5-dione
CID 98438078
N-ethyl-N-methyl-4-[2,3,4,5,6-pentakis[4-[ethyl(methyl)amino]phenyl]phenyl]aniline
CID 101400196
1-(3,4-dichlorophenyl)-N-ethyl-N-(4-fluorophenyl)methanesulfonamide
CID 56512863
2-N-(3,4-dichlorophenyl)-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 115132617
2,5,8-trichloro-N-ethyl-N-methylquinazolin-4-amine
CID 107051784

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-ethyl-N-methylaniline?
The IUPAC name of 3,4-dichloro-N-ethyl-N-methylaniline (CID 59726249) is 3,4-dichloro-N-ethyl-N-methylaniline.
What is the SMILES notation for 3,4-dichloro-N-ethyl-N-methylaniline?
The canonical SMILES for 3,4-dichloro-N-ethyl-N-methylaniline is CCN(C)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3,4-dichloro-N-ethyl-N-methylaniline?
The InChIKey is HTGBUVNUQKWOLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2N/c1-3-12(2)7-4-5-8(10)9(11)6-7/h4-6H,3H2,1-2H3.
What are the key properties of 3,4-dichloro-N-ethyl-N-methylaniline?
3,4-dichloro-N-ethyl-N-methylaniline has a molecular weight of 204.10 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-ethyl-N-methylaniline is sourced from PubChem (CID 59726249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).