2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone

C14H19NO3 — CID 173269942

IUPAC2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone
SMILESCc1cccc(COCC(=O)N2CCOCC2)c1
InChIInChI=1S/C14H19NO3/c1-12-3-2-4-13(9-12)10-18-11-14(16)15-5-7-17-8-6-15/h2-4,9H,5-8,10-11H2,1H3
InChIKeyGLNYRBDIKOIEPC-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.37
Rot. Bonds4

About 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone

2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone (PubChem CID 173269942) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone
PubChem CID173269942
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Name2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone
SMILESCc1cccc(COCC(=O)N2CCOCC2)c1
InChIInChI=1S/C14H19NO3/c1-12-3-2-4-13(9-12)10-18-11-14(16)15-5-7-17-8-6-15/h2-4,9H,5-8,10-11H2,1H3
InChIKeyGLNYRBDIKOIEPC-UHFFFAOYSA-N
XLogP1.37
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylphenyl)methyl]-3-morpholin-4-yl-3-oxopropanamide
CID 108943433
[4-[(3-methylphenyl)methyl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 110398802
3-(3-methylphenoxy)-1-morpholin-4-ylpropan-1-one
CID 60635766
1-methyl-3-[(3-methylphenyl)methoxymethyl]benzene
CID 15640186
2-(4-methylphenoxy)-1-morpholin-4-ylethanone
CID 674914
4-methyl-N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide
CID 1305731
(2-morpholin-4-yl-2-oxoethyl) 2,5-dimethyl-1-(3-methylphenyl)pyrrole-3-carboxylate
CID 40572132
2-[4-[(3-methylphenyl)iminomethyl]phenoxy]-1-morpholin-4-ylethanone
CID 126246748
5-methyl-2-(2-morpholin-4-yl-2-oxoethoxy)benzoic acid
CID 45304075
[1-[(3-methylphenyl)methyl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 25249252
1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone
CID 55578358
1-(azepan-1-yl)-2-phenylmethoxyethanone
CID 60646013

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone (CID 173269942) is 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone is Cc1cccc(COCC(=O)N2CCOCC2)c1.
What is the InChIKey of 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone?
The InChIKey is GLNYRBDIKOIEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-12-3-2-4-13(9-12)10-18-11-14(16)15-5-7-17-8-6-15/h2-4,9H,5-8,10-11H2,1H3.
What are the key properties of 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone?
2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone has a molecular weight of 249.31 g/mol, XLogP of 1.37, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methylphenyl)methoxy]-1-morpholin-4-ylethanone is sourced from PubChem (CID 173269942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).