N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine

C18H24N2O — CID 79262667

IUPACN-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
SMILESCCNC(C)c1ccc(C)cc1OCc1cccc(C)n1
InChIInChI=1S/C18H24N2O/c1-5-19-15(4)17-10-9-13(2)11-18(17)21-12-16-8-6-7-14(3)20-16/h6-11,15,19H,5,12H2,1-4H3
InChIKeyZFNVGIPGIUUIIO-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.95
Rot. Bonds6

About N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine

N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine (PubChem CID 79262667) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
PubChem CID79262667
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
SMILESCCNC(C)c1ccc(C)cc1OCc1cccc(C)n1
InChIInChI=1S/C18H24N2O/c1-5-19-15(4)17-10-9-13(2)11-18(17)21-12-16-8-6-7-14(3)20-16/h6-11,15,19H,5,12H2,1-4H3
InChIKeyZFNVGIPGIUUIIO-UHFFFAOYSA-N
XLogP3.95
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 ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine?
The IUPAC name of N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine (CID 79262667) is N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine.
What is the SMILES notation for N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine?
The canonical SMILES for N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine is CCNC(C)c1ccc(C)cc1OCc1cccc(C)n1.
What is the InChIKey of N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine?
The InChIKey is ZFNVGIPGIUUIIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-5-19-15(4)17-10-9-13(2)11-18(17)21-12-16-8-6-7-14(3)20-16/h6-11,15,19H,5,12H2,1-4H3.
What are the key properties of N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine?
N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine has a molecular weight of 284.40 g/mol, XLogP of 3.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 79262667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).