2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine

C16H18Cl2N2 — CID 107503368

IUPAC2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine
SMILESCNC(Cc1c(Cl)cccc1Cl)c1cc(C)nc(C)c1
InChIInChI=1S/C16H18Cl2N2/c1-10-7-12(8-11(2)20-10)16(19-3)9-13-14(17)5-4-6-15(13)18/h4-8,16,19H,9H2,1-3H3
InChIKeyWOVBXGCDTYEGTR-UHFFFAOYSA-N
MW309.24 g/mol
LogP4.51
Rot. Bonds4

About 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine

2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine (PubChem CID 107503368) has the molecular formula C16H18Cl2N2 and a molecular weight of 309.24 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine
PubChem CID107503368
Molecular FormulaC16H18Cl2N2
Molecular Weight309.24 g/mol
Exact Mass308.08
IUPAC Name2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine
SMILESCNC(Cc1c(Cl)cccc1Cl)c1cc(C)nc(C)c1
InChIInChI=1S/C16H18Cl2N2/c1-10-7-12(8-11(2)20-10)16(19-3)9-13-14(17)5-4-6-15(13)18/h4-8,16,19H,9H2,1-3H3
InChIKeyWOVBXGCDTYEGTR-UHFFFAOYSA-N
XLogP4.51
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.24
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine
CID 107503364
1-(4-bromo-3,5-dimethylphenyl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 114330396
2-(2,6-dichlorophenyl)-1-(3,5-difluorophenyl)-N-methylethanamine
CID 63417365
2-(4-chloro-2-fluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine
CID 107503685
1-(3-chloro-4-fluorophenyl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 63418484
2-(2-chloro-6-fluorophenyl)-1-(3,4-dichlorophenyl)-N-methylethanamine
CID 43486472
[2-(2,6-dichlorophenyl)-1-(4,6-dimethyl-2-pyridinyl)ethyl]hydrazine
CID 114269568
1-(2,6-dimethyl-4-pyridinyl)-N-methylpropan-1-amine
CID 107503443
1-(2,4-dichlorophenyl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 115830438
2-(2,6-dichlorophenyl)-N-methyl-1-(4-methyl-3-pyridinyl)ethanamine
CID 66270996
2-(2,6-dichlorophenyl)-N-methyl-1-(1H-1,2,4-triazol-5-yl)ethanamine
CID 65363305
1-(5-chlorofuran-2-yl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 106691674

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine?
The IUPAC name of 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine (CID 107503368) is 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine is CNC(Cc1c(Cl)cccc1Cl)c1cc(C)nc(C)c1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine?
The InChIKey is WOVBXGCDTYEGTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Cl2N2/c1-10-7-12(8-11(2)20-10)16(19-3)9-13-14(17)5-4-6-15(13)18/h4-8,16,19H,9H2,1-3H3.
What are the key properties of 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine?
2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine has a molecular weight of 309.24 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine is sourced from PubChem (CID 107503368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).