2,6-dichloro-N-methylaniline

C7H7Cl2N — CID 14611926

IUPAC2,6-dichloro-N-methylaniline
SMILESCNc1c(Cl)cccc1Cl
InChIInChI=1S/C7H7Cl2N/c1-10-7-5(8)3-2-4-6(7)9/h2-4,10H,1H3
InChIKeyFRJFKKCYRHRKRP-UHFFFAOYSA-N
MW176.05 g/mol
LogP3.04
Rot. Bonds1

About 2,6-dichloro-N-methylaniline

2,6-dichloro-N-methylaniline (PubChem CID 14611926) has the molecular formula C7H7Cl2N and a molecular weight of 176.05 g/mol. Its IUPAC name is 2,6-dichloro-N-methylaniline.

Molecular Properties

Compound Name2,6-dichloro-N-methylaniline
PubChem CID14611926
Molecular FormulaC7H7Cl2N
Molecular Weight176.05 g/mol
Exact Mass175.00
IUPAC Name2,6-dichloro-N-methylaniline
SMILESCNc1c(Cl)cccc1Cl
InChIInChI=1S/C7H7Cl2N/c1-10-7-5(8)3-2-4-6(7)9/h2-4,10H,1H3
InChIKeyFRJFKKCYRHRKRP-UHFFFAOYSA-N
XLogP3.04
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.05
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-Chloro-N-methylbenzenamine
CID 70272
2,6-Dichloroaniline
CID 11846
Acetamide, N-(2,6-dichlorophenyl)-
CID 28698
2,6-Dichloro-N,N-dimethylaniline
CID 42057
N-(2,6-Dichlorophenyl)thiourea
CID 722776
Aniline, o-chloro-N,N-dimethyl-
CID 12772
Formamide, N-(2-chlorophenyl)-
CID 137653
2,6-Dichloro-N-phenylaniline
CID 84867
Benzenamine, 2-chloro-N-methyl-
CID 136736
3-chloro-N-methylaniline
CID 138900
Guanclofine
CID 68754
2,4-Dichloro-N-methylaniline
CID 2800935

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-methylaniline?
The IUPAC name of 2,6-dichloro-N-methylaniline (CID 14611926) is 2,6-dichloro-N-methylaniline.
What is the SMILES notation for 2,6-dichloro-N-methylaniline?
The canonical SMILES for 2,6-dichloro-N-methylaniline is CNc1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-methylaniline?
The InChIKey is FRJFKKCYRHRKRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7Cl2N/c1-10-7-5(8)3-2-4-6(7)9/h2-4,10H,1H3.
What are the key properties of 2,6-dichloro-N-methylaniline?
2,6-dichloro-N-methylaniline has a molecular weight of 176.05 g/mol, XLogP of 3.04, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-methylaniline is sourced from PubChem (CID 14611926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).