1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine

C16H26N2O2 — CID 60860565

IUPAC1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
SMILESCCC1COCCN1Cc1cc(C(C)N)ccc1OC
InChIInChI=1S/C16H26N2O2/c1-4-15-11-20-8-7-18(15)10-14-9-13(12(2)17)5-6-16(14)19-3/h5-6,9,12,15H,4,7-8,10-11,17H2,1-3H3
InChIKeyRCCCPLSWOKTZJK-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.33
Rot. Bonds5

About 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine

1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine (PubChem CID 60860565) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine.

Molecular Properties

Compound Name1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
PubChem CID60860565
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
SMILESCCC1COCCN1Cc1cc(C(C)N)ccc1OC
InChIInChI=1S/C16H26N2O2/c1-4-15-11-20-8-7-18(15)10-14-9-13(12(2)17)5-6-16(14)19-3/h5-6,9,12,15H,4,7-8,10-11,17H2,1-3H3
InChIKeyRCCCPLSWOKTZJK-UHFFFAOYSA-N
XLogP2.33
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
CID 61424137
4-[[5-(1-aminoethyl)-2-methoxyphenyl]methyl]morpholin-3-one
CID 79467860
1-[3-[(4-ethylpiperazin-1-yl)methyl]-4-methoxyphenyl]ethanamine
CID 60860556
5-[(3-ethylmorpholin-4-yl)methyl]-2-methoxybenzenecarboximidamide
CID 65338703
4-[(2-bromo-5-methoxyphenyl)methyl]-3-ethylmorpholine
CID 65326745
5-[(3-ethylmorpholin-4-yl)methyl]-2-methoxybenzonitrile
CID 65344113
[4-[(3,4-dimethoxyphenyl)methyl]morpholin-3-yl]methanamine
CID 83096554
N-[[4-[(5-bromo-2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-1-amine
CID 83101094
2-(3-ethylmorpholin-4-yl)-1-(4-propan-2-ylphenyl)ethanamine
CID 43613076
N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83100679
4-[(3-ethylmorpholin-4-yl)methyl]-2-methoxybenzoic acid
CID 106793496
1-[4-methoxy-3-[(3-methoxy-4-methylpiperidin-1-yl)methyl]phenyl]ethanamine
CID 102965482

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine?
The IUPAC name of 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine (CID 60860565) is 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine.
What is the SMILES notation for 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine?
The canonical SMILES for 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine is CCC1COCCN1Cc1cc(C(C)N)ccc1OC.
What is the InChIKey of 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine?
The InChIKey is RCCCPLSWOKTZJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-15-11-20-8-7-18(15)10-14-9-13(12(2)17)5-6-16(14)19-3/h5-6,9,12,15H,4,7-8,10-11,17H2,1-3H3.
What are the key properties of 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine?
1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine has a molecular weight of 278.40 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine is sourced from PubChem (CID 60860565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).