2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine

C16H20N2O — CID 80640333

IUPAC2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine
SMILESCc1ccc(Oc2ncc(CCN)cc2C)c(C)c1
InChIInChI=1S/C16H20N2O/c1-11-4-5-15(12(2)8-11)19-16-13(3)9-14(6-7-17)10-18-16/h4-5,8-10H,6-7,17H2,1-3H3
InChIKeyKSWINFHLOUXULH-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.30
Rot. Bonds4

About 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine

2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine (PubChem CID 80640333) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine
PubChem CID80640333
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine
SMILESCc1ccc(Oc2ncc(CCN)cc2C)c(C)c1
InChIInChI=1S/C16H20N2O/c1-11-4-5-15(12(2)8-11)19-16-13(3)9-14(6-7-17)10-18-16/h4-5,8-10H,6-7,17H2,1-3H3
InChIKeyKSWINFHLOUXULH-UHFFFAOYSA-N
XLogP3.30
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(2-chloro-4-methylphenoxy)-5-methyl-3-pyridinyl]ethanamine
CID 80639335
2-[6-(2-bromo-4-fluorophenoxy)-5-methyl-3-pyridinyl]ethanamine
CID 80640534
2-[6-(2-bromo-4-methoxyphenoxy)-5-methyl-3-pyridinyl]ethanamine
CID 104708631
2-[6-(5-bromo-2-chlorophenoxy)-5-methyl-3-pyridinyl]ethanamine
CID 80639815
2-[6-(4-bromo-3,5-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine
CID 107727015
2-[4-(2-bromo-4-methylphenoxy)-3-methylphenyl]ethanamine
CID 63802463
[5-methyl-6-(3-methylphenoxy)-3-pyridinyl]methanamine
CID 80636065
1-[6-(2-chloro-4-methylphenoxy)-5-methyl-3-pyridinyl]propan-2-amine
CID 80639516
2-[3-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]ethanamine
CID 22687843
5-(chloromethyl)-2-(2-chloro-5-methylphenoxy)-3-methylpyridine
CID 80628031
1-[6-(2-methoxy-4-methylphenoxy)-5-methyl-3-pyridinyl]-N-methylmethanamine
CID 80635567
2-(5,6-dimethoxy-3-pyridinyl)ethanamine
CID 66847650

Frequently Asked Questions

What is the IUPAC name of 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine?
The IUPAC name of 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine (CID 80640333) is 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine.
What is the SMILES notation for 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine?
The canonical SMILES for 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine is Cc1ccc(Oc2ncc(CCN)cc2C)c(C)c1.
What is the InChIKey of 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine?
The InChIKey is KSWINFHLOUXULH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11-4-5-15(12(2)8-11)19-16-13(3)9-14(6-7-17)10-18-16/h4-5,8-10H,6-7,17H2,1-3H3.
What are the key properties of 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine?
2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine has a molecular weight of 256.35 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2,4-dimethylphenoxy)-5-methyl-3-pyridinyl]ethanamine is sourced from PubChem (CID 80640333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).