2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide

C14H18N2O3 — CID 140595700

IUPAC2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide
SMILESCCCCN1OC[C@@H](c2ccccc2C(N)=O)C1=O
InChIInChI=1S/C14H18N2O3/c1-2-3-8-16-14(18)12(9-19-16)10-6-4-5-7-11(10)13(15)17/h4-7,12H,2-3,8-9H2,1H3,(H2,15,17)/t12-/m0/s1
InChIKeyJSORPCRKXXJPMN-LBPRGKRZSA-N
MW262.31 g/mol
LogP1.44
Rot. Bonds5

About 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide

2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide (PubChem CID 140595700) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide.

Molecular Properties

Compound Name2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide
PubChem CID140595700
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide
SMILESCCCCN1OC[C@@H](c2ccccc2C(N)=O)C1=O
InChIInChI=1S/C14H18N2O3/c1-2-3-8-16-14(18)12(9-19-16)10-6-4-5-7-11(10)13(15)17/h4-7,12H,2-3,8-9H2,1H3,(H2,15,17)/t12-/m0/s1
InChIKeyJSORPCRKXXJPMN-LBPRGKRZSA-N
XLogP1.44
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide?
The IUPAC name of 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide (CID 140595700) is 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide.
What is the SMILES notation for 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide?
The canonical SMILES for 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide is CCCCN1OC[C@@H](c2ccccc2C(N)=O)C1=O.
What is the InChIKey of 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide?
The InChIKey is JSORPCRKXXJPMN-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-2-3-8-16-14(18)12(9-19-16)10-6-4-5-7-11(10)13(15)17/h4-7,12H,2-3,8-9H2,1H3,(H2,15,17)/t12-/m0/s1.
What are the key properties of 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide?
2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide has a molecular weight of 262.31 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-2-butyl-3-oxo-1,2-oxazolidin-4-yl]benzamide is sourced from PubChem (CID 140595700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).