4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one

C15H22N2O2 — CID 79468530

IUPAC4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one
SMILESCCNC(CN1CCOCC1=O)c1ccc(C)cc1
InChIInChI=1S/C15H22N2O2/c1-3-16-14(13-6-4-12(2)5-7-13)10-17-8-9-19-11-15(17)18/h4-7,14,16H,3,8-11H2,1-2H3
InChIKeyKTMZUALHHARVTQ-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.50
Rot. Bonds5

About 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one

4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one (PubChem CID 79468530) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one.

Molecular Properties

Compound Name4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one
PubChem CID79468530
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one
SMILESCCNC(CN1CCOCC1=O)c1ccc(C)cc1
InChIInChI=1S/C15H22N2O2/c1-3-16-14(13-6-4-12(2)5-7-13)10-17-8-9-19-11-15(17)18/h4-7,14,16H,3,8-11H2,1-2H3
InChIKeyKTMZUALHHARVTQ-UHFFFAOYSA-N
XLogP1.50
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(4-methylphenyl)-2-(propylamino)ethyl]morpholin-3-one
CID 79469491
4-[2-methyl-2-(4-methylphenyl)propyl]morpholin-3-one
CID 59020126
4-[2-(propylamino)propyl]morpholin-3-one
CID 79468803
4-[2-(propylamino)pentyl]morpholin-3-one
CID 79467992
4-(2-hydroxy-2-phenylethyl)morpholin-3-one
CID 79469635
4-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]morpholin-3-one
CID 79467881
1-(4-methylphenyl)-N-(1-morpholin-4-ylpropan-2-yl)propan-1-amine
CID 43675888
4-(3-amino-2-phenylpropyl)morpholin-3-one
CID 79468237
N-ethyl-1-(4-methylphenyl)-2-(oxan-4-ylsulfonyl)ethanamine
CID 64675879
1-[2-(ethylamino)-2-(4-methylphenyl)ethyl]-4-methylpyrazine-2,3-dione
CID 62929078
N-ethyl-1-(4-methylphenyl)-2-(oxan-4-ylsulfanyl)ethanamine
CID 64626571
1-[2-(ethylamino)-2-(4-propan-2-ylphenyl)ethyl]-4-methylpyrrolidin-2-one
CID 63103731

Frequently Asked Questions

What is the IUPAC name of 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one?
The IUPAC name of 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one (CID 79468530) is 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one.
What is the SMILES notation for 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one?
The canonical SMILES for 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one is CCNC(CN1CCOCC1=O)c1ccc(C)cc1.
What is the InChIKey of 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one?
The InChIKey is KTMZUALHHARVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-16-14(13-6-4-12(2)5-7-13)10-17-8-9-19-11-15(17)18/h4-7,14,16H,3,8-11H2,1-2H3.
What are the key properties of 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one?
4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one has a molecular weight of 262.35 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one is sourced from PubChem (CID 79468530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).