2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine

C18H24N2O — CID 105099080

IUPAC2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine
SMILESCCNC(Cc1cc(C)cc(C)c1)c1cccnc1OC
InChIInChI=1S/C18H24N2O/c1-5-19-17(16-7-6-8-20-18(16)21-4)12-15-10-13(2)9-14(3)11-15/h6-11,17,19H,5,12H2,1-4H3
InChIKeyLXOWBHFHRDEKDR-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.60
Rot. Bonds6

About 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine

2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine (PubChem CID 105099080) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine
PubChem CID105099080
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine
SMILESCCNC(Cc1cc(C)cc(C)c1)c1cccnc1OC
InChIInChI=1S/C18H24N2O/c1-5-19-17(16-7-6-8-20-18(16)21-4)12-15-10-13(2)9-14(3)11-15/h6-11,17,19H,5,12H2,1-4H3
InChIKeyLXOWBHFHRDEKDR-UHFFFAOYSA-N
XLogP3.60
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 105167171
N-ethyl-1-(2-methoxy-3-pyridinyl)-3-phenylpropan-1-amine
CID 105094165
N-ethyl-2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105162407
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105136035
2-(4-bromo-1,3-dimethylpyrazol-5-yl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105160979
N-ethyl-2-(4-ethylphenyl)-1-(2-methyl-3-pyridinyl)ethanamine
CID 105101754
N-[1-(2-methoxy-3-pyridinyl)-2-pyridin-2-ylethyl]propan-1-amine
CID 105158151
N-[1-(2-methoxy-3-pyridinyl)-2-(1-methylpyrazol-4-yl)ethyl]propan-1-amine
CID 105114314
1-(2-methoxy-3-pyridinyl)propylhydrazine
CID 105281861
1-(3,5-dimethylphenyl)-1-(2-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105097099
2-(4-chlorophenyl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine
CID 105085579
2-(4-iodophenyl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine
CID 105151971

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine?
The IUPAC name of 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine (CID 105099080) is 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine is CCNC(Cc1cc(C)cc(C)c1)c1cccnc1OC.
What is the InChIKey of 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine?
The InChIKey is LXOWBHFHRDEKDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-5-19-17(16-7-6-8-20-18(16)21-4)12-15-10-13(2)9-14(3)11-15/h6-11,17,19H,5,12H2,1-4H3.
What are the key properties of 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine?
2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine has a molecular weight of 284.40 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine is sourced from PubChem (CID 105099080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).