N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide

C14H18N2O3 — CID 140849838

IUPACN-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide
SMILESCC(C)(C)C1COC(=O)N1NC(=O)c1ccccc1
InChIInChI=1S/C14H18N2O3/c1-14(2,3)11-9-19-13(18)16(11)15-12(17)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,17)
InChIKeyXTBUFKXUSDSKOO-UHFFFAOYSA-N
MW262.31 g/mol
LogP2.20
Rot. Bonds2

About N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide

N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide (PubChem CID 140849838) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide.

Molecular Properties

Compound NameN-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide
PubChem CID140849838
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide
SMILESCC(C)(C)C1COC(=O)N1NC(=O)c1ccccc1
InChIInChI=1S/C14H18N2O3/c1-14(2,3)11-9-19-13(18)16(11)15-12(17)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,17)
InChIKeyXTBUFKXUSDSKOO-UHFFFAOYSA-N
XLogP2.20
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide?
The IUPAC name of N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide (CID 140849838) is N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide.
What is the SMILES notation for N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide?
The canonical SMILES for N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide is CC(C)(C)C1COC(=O)N1NC(=O)c1ccccc1.
What is the InChIKey of N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide?
The InChIKey is XTBUFKXUSDSKOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-14(2,3)11-9-19-13(18)16(11)15-12(17)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,17).
What are the key properties of N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide?
N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide has a molecular weight of 262.31 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butyl-2-oxo-1,3-oxazolidin-3-yl)benzamide is sourced from PubChem (CID 140849838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).