(4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one

C11H13NO3 — CID 10398104

IUPAC(4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc(C[C@@H]2COC(=O)N2)cc1
InChIInChI=1S/C11H13NO3/c1-14-10-4-2-8(3-5-10)6-9-7-15-11(13)12-9/h2-5,9H,6-7H2,1H3,(H,12,13)/t9-/m1/s1
InChIKeyJRFOJGQYMDFHGV-SECBINFHSA-N
MW207.23 g/mol
LogP1.35
Rot. Bonds3

About (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one

(4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one (PubChem CID 10398104) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one
PubChem CID10398104
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name(4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc(C[C@@H]2COC(=O)N2)cc1
InChIInChI=1S/C11H13NO3/c1-14-10-4-2-8(3-5-10)6-9-7-15-11(13)12-9/h2-5,9H,6-7H2,1H3,(H,12,13)/t9-/m1/s1
InChIKeyJRFOJGQYMDFHGV-SECBINFHSA-N
XLogP1.35
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4S)-4-[2-(4-methoxyphenyl)ethyl]-1,3-oxazolidin-2-one
CID 10933011
4-[(4-propoxyphenyl)methyl]-1,3-oxazolidin-2-one
CID 18338957
(4S)-4-[(4-aminophenyl)methyl]-1,3-oxazolidin-2-one;ethane
CID 143785043
4-[(4-iodophenyl)methyl]-1,3-oxazolidin-2-one
CID 175523266
(5S)-5-[(4-methoxyphenyl)methyl]morpholin-3-one
CID 166471827
2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide
CID 11323624
2-[(4-methoxyphenyl)methyl]azetidine
CID 71756117
N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide
CID 110648512
4-[(4-methoxyphenyl)methyl]oxan-3-one
CID 66825112
4-[(4-amino-3-iodophenyl)methyl]-1,3-oxazolidin-2-one
CID 19358405
1-(cyclopropylmethyl)-4-methoxybenzene
CID 6422476
2-[(4-methoxyphenyl)methyl]cyclopentan-1-one
CID 11790327

Frequently Asked Questions

What is the IUPAC name of (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one?
The IUPAC name of (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one (CID 10398104) is (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one is COc1ccc(C[C@@H]2COC(=O)N2)cc1.
What is the InChIKey of (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one?
The InChIKey is JRFOJGQYMDFHGV-SECBINFHSA-N. The full InChI is InChI=1S/C11H13NO3/c1-14-10-4-2-8(3-5-10)6-9-7-15-11(13)12-9/h2-5,9H,6-7H2,1H3,(H,12,13)/t9-/m1/s1.
What are the key properties of (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one?
(4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one has a molecular weight of 207.23 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 10398104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).