2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine

C18H24N2 — CID 105174636

IUPAC2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
SMILESCCNC(Cc1c(C)cccc1C)c1cccnc1C
InChIInChI=1S/C18H24N2/c1-5-19-18(16-10-7-11-20-15(16)4)12-17-13(2)8-6-9-14(17)3/h6-11,18-19H,5,12H2,1-4H3
InChIKeyYYULAAYNDRBASZ-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.90
Rot. Bonds5

About 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine

2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine (PubChem CID 105174636) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
PubChem CID105174636
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
SMILESCCNC(Cc1c(C)cccc1C)c1cccnc1C
InChIInChI=1S/C18H24N2/c1-5-19-18(16-10-7-11-20-15(16)4)12-17-13(2)8-6-9-14(17)3/h6-11,18-19H,5,12H2,1-4H3
InChIKeyYYULAAYNDRBASZ-UHFFFAOYSA-N
XLogP3.90
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine (CID 105174636) is 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine is CCNC(Cc1c(C)cccc1C)c1cccnc1C.
What is the InChIKey of 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine?
The InChIKey is YYULAAYNDRBASZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-5-19-18(16-10-7-11-20-15(16)4)12-17-13(2)8-6-9-14(17)3/h6-11,18-19H,5,12H2,1-4H3.
What are the key properties of 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine?
2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine has a molecular weight of 268.40 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 105174636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).