(4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide

C14H18N2O4 — CID 95415189

IUPAC(4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide
SMILESCc1ccc(OCCN(C)C(=O)[C@H]2COC(=O)N2)cc1
InChIInChI=1S/C14H18N2O4/c1-10-3-5-11(6-4-10)19-8-7-16(2)13(17)12-9-20-14(18)15-12/h3-6,12H,7-9H2,1-2H3,(H,15,18)/t12-/m1/s1
InChIKeyHJNRZMGYMUFHLH-GFCCVEGCSA-N
MW278.31 g/mol
LogP0.94
Rot. Bonds5

About (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide

(4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide (PubChem CID 95415189) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide
PubChem CID95415189
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name(4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide
SMILESCc1ccc(OCCN(C)C(=O)[C@H]2COC(=O)N2)cc1
InChIInChI=1S/C14H18N2O4/c1-10-3-5-11(6-4-10)19-8-7-16(2)13(17)12-9-20-14(18)15-12/h3-6,12H,7-9H2,1-2H3,(H,15,18)/t12-/m1/s1
InChIKeyHJNRZMGYMUFHLH-GFCCVEGCSA-N
XLogP0.94
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide?
The IUPAC name of (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide (CID 95415189) is (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide.
What is the SMILES notation for (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide?
The canonical SMILES for (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide is Cc1ccc(OCCN(C)C(=O)[C@H]2COC(=O)N2)cc1.
What is the InChIKey of (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide?
The InChIKey is HJNRZMGYMUFHLH-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-10-3-5-11(6-4-10)19-8-7-16(2)13(17)12-9-20-14(18)15-12/h3-6,12H,7-9H2,1-2H3,(H,15,18)/t12-/m1/s1.
What are the key properties of (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide?
(4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide has a molecular weight of 278.31 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide is sourced from PubChem (CID 95415189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).