N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine

C18H24N2O — CID 62296699

IUPACN-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1c(C)cc(C)nc1Oc1cccc(CC)c1
InChIInChI=1S/C18H24N2O/c1-5-15-8-7-9-16(11-15)21-18-17(12-19-6-2)13(3)10-14(4)20-18/h7-11,19H,5-6,12H2,1-4H3
InChIKeyXMOWZTRAPBFEJB-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.16
Rot. Bonds6

About N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine

N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine (PubChem CID 62296699) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
PubChem CID62296699
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1c(C)cc(C)nc1Oc1cccc(CC)c1
InChIInChI=1S/C18H24N2O/c1-5-15-8-7-9-16(11-15)21-18-17(12-19-6-2)13(3)10-14(4)20-18/h7-11,19H,5-6,12H2,1-4H3
InChIKeyXMOWZTRAPBFEJB-UHFFFAOYSA-N
XLogP4.16
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 ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(4-fluorophenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
CID 62296113
N-[[4,6-dimethyl-2-(3-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62296977
1-[2-(3-ethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
CID 62335805
N-[[2-(2-fluorophenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
CID 62297821
[2-(3-ethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol
CID 62336171
1-[2-(3,4-dimethylphenoxy)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
CID 62296968
N-[[6-(3-ethylphenoxy)-3-pyridinyl]methyl]ethanamine
CID 62296868
N-[[2-(2-bromo-4-fluorophenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
CID 62296558
4-(3-ethylphenoxy)-N,5-dimethylpyrimidin-2-amine
CID 80860603
1-[2-(4-chloro-3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
CID 62321886
N-[[3-(3-methylphenoxy)phenyl]methyl]ethanamine
CID 63942314
N-[[2-(2-methoxyethoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
CID 62292538

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine (CID 62296699) is N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine is CCNCc1c(C)cc(C)nc1Oc1cccc(CC)c1.
What is the InChIKey of N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine?
The InChIKey is XMOWZTRAPBFEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-5-15-8-7-9-16(11-15)21-18-17(12-19-6-2)13(3)10-14(4)20-18/h7-11,19H,5-6,12H2,1-4H3.
What are the key properties of N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine?
N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine has a molecular weight of 284.40 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-ethylphenoxy)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62296699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).