N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide

C13H18N2O3 — CID 112737306

IUPACN-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide
SMILESCCc1ccc(NC(=O)CN2C[C@@H](O)CO2)cc1
InChIInChI=1S/C13H18N2O3/c1-2-10-3-5-11(6-4-10)14-13(17)8-15-7-12(16)9-18-15/h3-6,12,16H,2,7-9H2,1H3,(H,14,17)/t12-/m1/s1
InChIKeyMYZNZRBXLUFBBK-GFCCVEGCSA-N
MW250.30 g/mol
LogP0.80
Rot. Bonds4

About N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide

N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide (PubChem CID 112737306) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide
PubChem CID112737306
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide
SMILESCCc1ccc(NC(=O)CN2C[C@@H](O)CO2)cc1
InChIInChI=1S/C13H18N2O3/c1-2-10-3-5-11(6-4-10)14-13(17)8-15-7-12(16)9-18-15/h3-6,12,16H,2,7-9H2,1H3,(H,14,17)/t12-/m1/s1
InChIKeyMYZNZRBXLUFBBK-GFCCVEGCSA-N
XLogP0.80
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chlorophenyl)-2-(4-hydroxy-1,2-oxazolidin-2-yl)acetamide
CID 112737124
2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N-(4-ethylphenyl)acetamide
CID 8899824
N-(3-cyanophenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide
CID 112737330
N-(2-bromophenyl)-2-(4-hydroxy-1,2-oxazolidin-2-yl)acetamide
CID 112737177
2-[1-[2-(4-ethylanilino)-2-oxoethyl]azetidin-3-yl]acetic acid
CID 64616490
2-[1-[2-(4-ethylanilino)-2-oxoethyl]azetidin-3-yl]propanoic acid
CID 116683844
N-(4-ethylphenyl)-2-[(3S)-3-methylpiperazin-1-yl]acetamide
CID 104976875
N-(4-ethylphenyl)-2-(4-propylpiperazin-1-yl)acetamide
CID 22196973
N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide
CID 95774756
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide
CID 119927919
2-(4-acetamidopiperidin-1-yl)-N-(4-ethylphenyl)acetamide
CID 3220742
N-(4-ethylphenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 121064147

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide?
The IUPAC name of N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide (CID 112737306) is N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide is CCc1ccc(NC(=O)CN2C[C@@H](O)CO2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide?
The InChIKey is MYZNZRBXLUFBBK-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-2-10-3-5-11(6-4-10)14-13(17)8-15-7-12(16)9-18-15/h3-6,12,16H,2,7-9H2,1H3,(H,14,17)/t12-/m1/s1.
What are the key properties of N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide?
N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide has a molecular weight of 250.30 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]acetamide is sourced from PubChem (CID 112737306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).