1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one

C15H21NO3 — CID 110327157

IUPAC1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one
SMILESCOc1ccc(C2CN(C(=O)C(C)C)CCO2)cc1
InChIInChI=1S/C15H21NO3/c1-11(2)15(17)16-8-9-19-14(10-16)12-4-6-13(18-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3
InChIKeyMBVWTJHACZSQJL-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.25
Rot. Bonds3

About 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one

1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one (PubChem CID 110327157) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one.

Molecular Properties

Compound Name1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one
PubChem CID110327157
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one
SMILESCOc1ccc(C2CN(C(=O)C(C)C)CCO2)cc1
InChIInChI=1S/C15H21NO3/c1-11(2)15(17)16-8-9-19-14(10-16)12-4-6-13(18-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3
InChIKeyMBVWTJHACZSQJL-UHFFFAOYSA-N
XLogP2.25
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-1-[2-(4-propan-2-ylphenyl)morpholin-4-yl]ethanone
CID 110364120
(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327180
2-(4-fluorophenyl)-1-[2-(4-methoxyphenyl)morpholin-4-yl]ethanone
CID 110327189
1-[2-(2-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one
CID 167278438
1,3-benzodioxol-5-yl-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327211
(2-fluorophenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327171
1-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-4-methylpentane-1,2-dione
CID 95545475
2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone
CID 25281339
2-(4-methoxyphenoxy)-1-[(2R)-2-phenylmorpholin-4-yl]ethanone
CID 25281342
(2S)-2-amino-1-[(2S)-2-(3-methoxyphenyl)morpholin-4-yl]-3-methylbutan-1-one
CID 99852551
methyl 2-(4-propan-2-ylphenyl)morpholine-4-carboxylate
CID 110364132
2-bromo-1-[2-(4-fluorophenyl)morpholin-4-yl]propan-1-one
CID 107904527

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one?
The IUPAC name of 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one (CID 110327157) is 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one.
What is the SMILES notation for 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one?
The canonical SMILES for 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one is COc1ccc(C2CN(C(=O)C(C)C)CCO2)cc1.
What is the InChIKey of 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one?
The InChIKey is MBVWTJHACZSQJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-11(2)15(17)16-8-9-19-14(10-16)12-4-6-13(18-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3.
What are the key properties of 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one?
1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one has a molecular weight of 263.34 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one is sourced from PubChem (CID 110327157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).