[4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate

C19H25NO5 — CID 54456815

IUPAC[4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate
SMILESCOCC1CN(c2ccc(C3CCC(OC(C)=O)CC3)cc2)C(=O)O1
InChIInChI=1S/C19H25NO5/c1-13(21)24-17-9-5-15(6-10-17)14-3-7-16(8-4-14)20-11-18(12-23-2)25-19(20)22/h3-4,7-8,15,17-18H,5-6,9-12H2,1-2H3
InChIKeyWYTRYFHTEQKGRC-UHFFFAOYSA-N
MW347.41 g/mol
LogP3.25
Rot. Bonds5

About [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate

[4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate (PubChem CID 54456815) has the molecular formula C19H25NO5 and a molecular weight of 347.41 g/mol. Its IUPAC name is [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate.

Molecular Properties

Compound Name[4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate
PubChem CID54456815
Molecular FormulaC19H25NO5
Molecular Weight347.41 g/mol
Exact Mass347.17
IUPAC Name[4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate
SMILESCOCC1CN(c2ccc(C3CCC(OC(C)=O)CC3)cc2)C(=O)O1
InChIInChI=1S/C19H25NO5/c1-13(21)24-17-9-5-15(6-10-17)14-3-7-16(8-4-14)20-11-18(12-23-2)25-19(20)22/h3-4,7-8,15,17-18H,5-6,9-12H2,1-2H3
InChIKeyWYTRYFHTEQKGRC-UHFFFAOYSA-N
XLogP3.25
TPSA65.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.41
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-cyclohexylphenyl)-5-(methoxymethyl)-1,3-oxazolidin-2-one
CID 15987062
ethyl 4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperidine-1-carboxylate
CID 86749980
4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperidine-1-carboxylate
CID 23371834
2-[4-[4-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexylidene]acetonitrile
CID 54090920
(5R)-5-(methoxymethyl)-3-[4-(3-oxobutoxy)phenyl]-1,3-oxazolidin-2-one
CID 18646211
[(2R)-4-[4-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenoxy]butan-2-yl] acetate
CID 18646229
3-(4-cyclopropylphenyl)-5-hexyl-1,3-oxazolidin-2-one
CID 59580221
(5R)-3-[4-(3-hydroxypropyl)phenyl]-5-(methoxymethyl)-1,3-oxazolidin-2-one
CID 10378182
5-[(4-cyclopentylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one
CID 59580300
[2-[4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperidin-1-yl]-1-hydroxy-2-oxoethyl] acetate
CID 57214552
(5R)-3-[3-fluoro-4-[2-fluoro-4-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]phenyl]-5-(methoxymethyl)-1,3-oxazolidin-2-one
CID 10411371
3-(7-hydroxynaphthalen-2-yl)-5-(methoxymethyl)-1,3-oxazolidin-2-one
CID 19012479

Frequently Asked Questions

What is the IUPAC name of [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate?
The IUPAC name of [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate (CID 54456815) is [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate.
What is the SMILES notation for [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate?
The canonical SMILES for [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate is COCC1CN(c2ccc(C3CCC(OC(C)=O)CC3)cc2)C(=O)O1.
What is the InChIKey of [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate?
The InChIKey is WYTRYFHTEQKGRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO5/c1-13(21)24-17-9-5-15(6-10-17)14-3-7-16(8-4-14)20-11-18(12-23-2)25-19(20)22/h3-4,7-8,15,17-18H,5-6,9-12H2,1-2H3.
What are the key properties of [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate?
[4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate has a molecular weight of 347.41 g/mol, XLogP of 3.25, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclohexyl] acetate is sourced from PubChem (CID 54456815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).