4-(2-methoxy-4-methylphenyl)morpholin-3-one

C12H15NO3 — CID 165482194

IUPAC4-(2-methoxy-4-methylphenyl)morpholin-3-one
SMILESCOc1cc(C)ccc1N1CCOCC1=O
InChIInChI=1S/C12H15NO3/c1-9-3-4-10(11(7-9)15-2)13-5-6-16-8-12(13)14/h3-4,7H,5-6,8H2,1-2H3
InChIKeyRYBVYCYTCQWYJA-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.37
Rot. Bonds2

About 4-(2-methoxy-4-methylphenyl)morpholin-3-one

4-(2-methoxy-4-methylphenyl)morpholin-3-one (PubChem CID 165482194) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 4-(2-methoxy-4-methylphenyl)morpholin-3-one.

Molecular Properties

Compound Name4-(2-methoxy-4-methylphenyl)morpholin-3-one
PubChem CID165482194
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name4-(2-methoxy-4-methylphenyl)morpholin-3-one
SMILESCOc1cc(C)ccc1N1CCOCC1=O
InChIInChI=1S/C12H15NO3/c1-9-3-4-10(11(7-9)15-2)13-5-6-16-8-12(13)14/h3-4,7H,5-6,8H2,1-2H3
InChIKeyRYBVYCYTCQWYJA-UHFFFAOYSA-N
XLogP1.37
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-fluoro-4-methylphenyl)morpholin-3-one
CID 58845389
7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione
CID 11016587
4-(6-methoxy-2-methyl-1,3-dihydroisoindol-5-yl)morpholin-3-one
CID 177238780
4-(6-methoxy-2,3-dihydro-1H-isoindol-5-yl)morpholin-3-one
CID 177238856
4-(3,4,5-trimethoxyphenyl)morpholin-3-one
CID 165481703
2-methoxy-4-(3-oxomorpholin-4-yl)benzaldehyde
CID 91756333
4-(4-bromo-2-methoxy-6-methylphenyl)morpholin-3-one
CID 165482080
4-[4-amino-2-(difluoromethoxy)phenyl]morpholin-3-one
CID 141122127
4-(4-methoxy-3-propan-2-yloxyphenyl)morpholin-3-one
CID 165481667
4,10,16,22-tetrakis(3-methylphenyl)-1,7,13,19-tetraoxa-4,10,16,22-tetrazacyclotetracosane-3,11,15,23-tetrone
CID 100991495
4-methyl-3-(3-oxomorpholin-4-yl)benzoic acid
CID 82513246
4-(3-chloro-2-methylphenyl)morpholin-3-one
CID 165473298

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-4-methylphenyl)morpholin-3-one?
The IUPAC name of 4-(2-methoxy-4-methylphenyl)morpholin-3-one (CID 165482194) is 4-(2-methoxy-4-methylphenyl)morpholin-3-one.
What is the SMILES notation for 4-(2-methoxy-4-methylphenyl)morpholin-3-one?
The canonical SMILES for 4-(2-methoxy-4-methylphenyl)morpholin-3-one is COc1cc(C)ccc1N1CCOCC1=O.
What is the InChIKey of 4-(2-methoxy-4-methylphenyl)morpholin-3-one?
The InChIKey is RYBVYCYTCQWYJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-9-3-4-10(11(7-9)15-2)13-5-6-16-8-12(13)14/h3-4,7H,5-6,8H2,1-2H3.
What are the key properties of 4-(2-methoxy-4-methylphenyl)morpholin-3-one?
4-(2-methoxy-4-methylphenyl)morpholin-3-one has a molecular weight of 221.26 g/mol, XLogP of 1.37, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-4-methylphenyl)morpholin-3-one is sourced from PubChem (CID 165482194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).