3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide

C16H22N2O3 — CID 110685427

IUPAC3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(NC(=O)CCC2CN(C)C(=O)O2)cc1
InChIInChI=1S/C16H22N2O3/c1-11(2)12-4-6-13(7-5-12)17-15(19)9-8-14-10-18(3)16(20)21-14/h4-7,11,14H,8-10H2,1-3H3,(H,17,19)
InChIKeyZGMFXYDUJFHYFP-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.98
Rot. Bonds5

About 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide

3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide (PubChem CID 110685427) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide
PubChem CID110685427
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(NC(=O)CCC2CN(C)C(=O)O2)cc1
InChIInChI=1S/C16H22N2O3/c1-11(2)12-4-6-13(7-5-12)17-15(19)9-8-14-10-18(3)16(20)21-14/h4-7,11,14H,8-10H2,1-3H3,(H,17,19)
InChIKeyZGMFXYDUJFHYFP-UHFFFAOYSA-N
XLogP2.98
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-methylphenyl)-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
CID 110685441
N-(2,6-difluorophenyl)-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
CID 110685519
N-(2-ethoxyphenyl)-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
CID 110685451
3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 110685499
N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
CID 110685500
N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
CID 110685347
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 112779006
5-(azepan-1-yl)-N-(4-propan-2-ylphenyl)pentanamide
CID 59840298
2-iodo-N-(4-propan-2-ylphenyl)acetamide
CID 60723215
3-(2-morpholin-4-ylethylamino)-N-(4-propan-2-ylphenyl)propanamide
CID 109016776
3-[acetyl(cyclohexyl)amino]-N-(4-propan-2-ylphenyl)propanamide
CID 113116612
5-oxo-5-(4-propan-2-ylanilino)pentanoate
CID 7038718

Frequently Asked Questions

What is the IUPAC name of 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide?
The IUPAC name of 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide (CID 110685427) is 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide.
What is the SMILES notation for 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide?
The canonical SMILES for 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide is CC(C)c1ccc(NC(=O)CCC2CN(C)C(=O)O2)cc1.
What is the InChIKey of 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide?
The InChIKey is ZGMFXYDUJFHYFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-11(2)12-4-6-13(7-5-12)17-15(19)9-8-14-10-18(3)16(20)21-14/h4-7,11,14H,8-10H2,1-3H3,(H,17,19).
What are the key properties of 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide?
3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide has a molecular weight of 290.36 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 110685427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).