2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide

C16H22N2O4 — CID 110726002

IUPAC2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide
SMILESCc1cccc(OCC(=O)NCC2CN(C(C)C)C(=O)O2)c1
InChIInChI=1S/C16H22N2O4/c1-11(2)18-9-14(22-16(18)20)8-17-15(19)10-21-13-6-4-5-12(3)7-13/h4-7,11,14H,8-10H2,1-3H3,(H,17,19)
InChIKeyZVGBAPGPQOEHJV-UHFFFAOYSA-N
MW306.36 g/mol
LogP1.72
Rot. Bonds6

About 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide

2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide (PubChem CID 110726002) has the molecular formula C16H22N2O4 and a molecular weight of 306.36 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide
PubChem CID110726002
Molecular FormulaC16H22N2O4
Molecular Weight306.36 g/mol
Exact Mass306.16
IUPAC Name2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide
SMILESCc1cccc(OCC(=O)NCC2CN(C(C)C)C(=O)O2)c1
InChIInChI=1S/C16H22N2O4/c1-11(2)18-9-14(22-16(18)20)8-17-15(19)10-21-13-6-4-5-12(3)7-13/h4-7,11,14H,8-10H2,1-3H3,(H,17,19)
InChIKeyZVGBAPGPQOEHJV-UHFFFAOYSA-N
XLogP1.72
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.36
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[3-(3-methylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-2-phenoxyacetamide
CID 110327784
3-(3-methoxyphenyl)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]propanamide
CID 110725983
2-(3-methylphenoxy)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]acetamide
CID 46684440
2-(3-methylphenoxy)-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)acetamide
CID 110736737
2-(4-methylphenoxy)-N-[[3-(4-methylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 16920637
3-fluoro-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110725933
N-[2-(methylamino)propyl]-2-(3-methylphenoxy)acetamide;hydrochloride
CID 120828955
N-(3-amino-2-methylpropyl)-2-(3-methylphenoxy)acetamide
CID 119998062
N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-(3-methylphenoxy)acetamide
CID 120943410
N-(3-aminobutyl)-2-(3-methylphenoxy)acetamide;hydrochloride
CID 119497988
N-(2,3-dihydroxypropyl)-2-(3-methylphenoxy)acetamide
CID 66177924
N-[[3-(4-methoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-2-(4-methylphenoxy)acetamide
CID 16921393

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide?
The IUPAC name of 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide (CID 110726002) is 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide is Cc1cccc(OCC(=O)NCC2CN(C(C)C)C(=O)O2)c1.
What is the InChIKey of 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide?
The InChIKey is ZVGBAPGPQOEHJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O4/c1-11(2)18-9-14(22-16(18)20)8-17-15(19)10-21-13-6-4-5-12(3)7-13/h4-7,11,14H,8-10H2,1-3H3,(H,17,19).
What are the key properties of 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide?
2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide has a molecular weight of 306.36 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide is sourced from PubChem (CID 110726002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).