4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine

C15H18N2O5S — CID 39413047

IUPAC4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine
SMILESCc1cc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)on1
InChIInChI=1S/C15H18N2O5S/c1-12-10-14(22-16-12)11-21-13-2-4-15(5-3-13)23(18,19)17-6-8-20-9-7-17/h2-5,10H,6-9,11H2,1H3
InChIKeyNMRRHXJGGVDSKC-UHFFFAOYSA-N
MW338.39 g/mol
LogP1.58
Rot. Bonds5

About 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine

4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine (PubChem CID 39413047) has the molecular formula C15H18N2O5S and a molecular weight of 338.39 g/mol. Its IUPAC name is 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine.

Molecular Properties

Compound Name4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine
PubChem CID39413047
Molecular FormulaC15H18N2O5S
Molecular Weight338.39 g/mol
Exact Mass338.09
IUPAC Name4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine
SMILESCc1cc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)on1
InChIInChI=1S/C15H18N2O5S/c1-12-10-14(22-16-12)11-21-13-2-4-15(5-3-13)23(18,19)17-6-8-20-9-7-17/h2-5,10H,6-9,11H2,1H3
InChIKeyNMRRHXJGGVDSKC-UHFFFAOYSA-N
XLogP1.58
TPSA81.87 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-[(4-methylphenyl)methoxy]phenyl]sulfonylmorpholine
CID 9331341
methyl 2-methyl-5-[(4-morpholin-4-ylsulfonylphenoxy)methyl]furan-3-carboxylate
CID 9331544
4-[4-[(3-methylphenyl)methoxy]phenyl]sulfonylmorpholine
CID 9332672
4-[4-[(4-iodophenoxy)methyl]phenyl]sulfonylmorpholine
CID 1300600
4-[4-[(2,3-difluorophenyl)methoxy]phenyl]sulfonylmorpholine
CID 39413041
3-(4-morpholin-4-ylsulfonylphenoxy)propanoic acid
CID 43314386
1-(2,5-dimethylthiophen-3-yl)-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone
CID 9332969
4-[4-[2-(4-chlorophenoxy)ethoxy]phenyl]sulfonylmorpholine
CID 34198649
4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine
CID 7612861
5-[(4-ethylphenoxy)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)furan-2-carboxamide
CID 19446653
4,10-bis-(4-methylphenyl)sulfonyl-1,7-dioxa-4,10-diazacyclododecane
CID 1101145
4-[4-[5-(phenoxymethyl)-1,2,4-oxadiazol-3-yl]phenyl]sulfonylmorpholine
CID 46329228

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine?
The IUPAC name of 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine (CID 39413047) is 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine.
What is the SMILES notation for 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine?
The canonical SMILES for 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine is Cc1cc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)on1.
What is the InChIKey of 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine?
The InChIKey is NMRRHXJGGVDSKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O5S/c1-12-10-14(22-16-12)11-21-13-2-4-15(5-3-13)23(18,19)17-6-8-20-9-7-17/h2-5,10H,6-9,11H2,1H3.
What are the key properties of 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine?
4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine has a molecular weight of 338.39 g/mol, XLogP of 1.58, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]sulfonylmorpholine is sourced from PubChem (CID 39413047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).