1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine

C17H28N2O2 — CID 61424137

IUPAC1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
SMILESCCC1COC(C)CN1Cc1cc(C(C)N)ccc1OC
InChIInChI=1S/C17H28N2O2/c1-5-16-11-21-12(2)9-19(16)10-15-8-14(13(3)18)6-7-17(15)20-4/h6-8,12-13,16H,5,9-11,18H2,1-4H3
InChIKeyRKVMSJJKSMYJCQ-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.71
Rot. Bonds5

About 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine

1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine (PubChem CID 61424137) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine.

Molecular Properties

Compound Name1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
PubChem CID61424137
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
SMILESCCC1COC(C)CN1Cc1cc(C(C)N)ccc1OC
InChIInChI=1S/C17H28N2O2/c1-5-16-11-21-12(2)9-19(16)10-15-8-14(13(3)18)6-7-17(15)20-4/h6-8,12-13,16H,5,9-11,18H2,1-4H3
InChIKeyRKVMSJJKSMYJCQ-UHFFFAOYSA-N
XLogP2.71
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyaniline
CID 43575113
1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
CID 60860565
2-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenol
CID 82974433
2-(5-ethyl-2-methylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanamine
CID 61424478
2-[4-[(5-ethyl-2-methylmorpholin-4-yl)methyl]phenyl]propan-1-amine
CID 105347526
1-[3-[(4-ethylpiperazin-1-yl)methyl]-4-methoxyphenyl]ethanamine
CID 60860556
1-[[5-(1-aminoethyl)-2-methoxyphenyl]methyl]-3,4-dimethylpyrrolidine-2,5-dione
CID 79178939
1-[4-methoxy-3-[(3-methoxy-4-methylpiperidin-1-yl)methyl]phenyl]ethanamine
CID 102965482
2-(5-ethyl-2-methylmorpholin-4-yl)-1-(4-ethylphenyl)ethanamine
CID 61424037
(1S)-1-[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]ethanamine
CID 93342575
1-[4-(5-ethyl-2-methylmorpholin-4-yl)sulfonylphenyl]ethanamine
CID 61424752
3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]pyridin-2-amine
CID 55075141

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine?
The IUPAC name of 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine (CID 61424137) is 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine.
What is the SMILES notation for 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine?
The canonical SMILES for 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine is CCC1COC(C)CN1Cc1cc(C(C)N)ccc1OC.
What is the InChIKey of 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine?
The InChIKey is RKVMSJJKSMYJCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-5-16-11-21-12(2)9-19(16)10-15-8-14(13(3)18)6-7-17(15)20-4/h6-8,12-13,16H,5,9-11,18H2,1-4H3.
What are the key properties of 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine?
1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine has a molecular weight of 292.42 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine is sourced from PubChem (CID 61424137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).