2-(4-methylphenoxy)-1-morpholin-4-ylethanone

C13H17NO3 — CID 674914

IUPAC2-(4-methylphenoxy)-1-morpholin-4-ylethanone
SMILESCc1ccc(OCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C13H17NO3/c1-11-2-4-12(5-3-11)17-10-13(15)14-6-8-16-9-7-14/h2-5H,6-10H2,1H3
InChIKeySAEOWDBSDCWWCA-UHFFFAOYSA-N
MW235.28 g/mol
LogP1.23
Rot. Bonds3

About 2-(4-methylphenoxy)-1-morpholin-4-ylethanone

2-(4-methylphenoxy)-1-morpholin-4-ylethanone (PubChem CID 674914) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(4-methylphenoxy)-1-morpholin-4-ylethanone
PubChem CID674914
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC Name2-(4-methylphenoxy)-1-morpholin-4-ylethanone
SMILESCc1ccc(OCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C13H17NO3/c1-11-2-4-12(5-3-11)17-10-13(15)14-6-8-16-9-7-14/h2-5H,6-10H2,1H3
InChIKeySAEOWDBSDCWWCA-UHFFFAOYSA-N
XLogP1.23
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-hydroxyphenoxy)-1-morpholin-4-ylethanone
CID 43143408
N,4-dimethyl-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]benzenesulfonamide
CID 1190688
1-[4-[2-(4-ethoxyphenoxy)acetyl]piperazin-1-yl]-2-(4-methylphenoxy)ethanone
CID 108536873
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide
CID 7203468
2-(4-methylphenoxy)-1-(1,3-oxazinan-3-yl)ethanone
CID 110739630
1-[4-[4-(aminomethyl)oxane-4-carbonyl]piperazin-1-yl]-2-(4-methylphenoxy)ethanone
CID 120929707
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-(4-methylphenoxy)ethanone
CID 110755929
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate
CID 139069446
2-(4-methylphenoxy)-1-(1,2,4-oxadiazinan-4-yl)ethanone
CID 71226962
2-[4-(ethylaminomethyl)phenoxy]-1-morpholin-4-ylethanone
CID 43276966
methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate
CID 2923381
1-(4,4-dimethylpiperidin-1-yl)-2-(4-methylphenoxy)ethanone
CID 110738619

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(4-methylphenoxy)-1-morpholin-4-ylethanone (CID 674914) is 2-(4-methylphenoxy)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(4-methylphenoxy)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(4-methylphenoxy)-1-morpholin-4-ylethanone is Cc1ccc(OCC(=O)N2CCOCC2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-1-morpholin-4-ylethanone?
The InChIKey is SAEOWDBSDCWWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-11-2-4-12(5-3-11)17-10-13(15)14-6-8-16-9-7-14/h2-5H,6-10H2,1H3.
What are the key properties of 2-(4-methylphenoxy)-1-morpholin-4-ylethanone?
2-(4-methylphenoxy)-1-morpholin-4-ylethanone has a molecular weight of 235.28 g/mol, XLogP of 1.23, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-1-morpholin-4-ylethanone is sourced from PubChem (CID 674914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).