N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide

C16H20N2O3 — CID 39139782

IUPACN-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide
SMILESO=C(Nc1cccc(N2CCOC2=O)c1)C1CCCCC1
InChIInChI=1S/C16H20N2O3/c19-15(12-5-2-1-3-6-12)17-13-7-4-8-14(11-13)18-9-10-21-16(18)20/h4,7-8,11-12H,1-3,5-6,9-10H2,(H,17,19)
InChIKeyMHTNOVLQJJXMJF-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.16
Rot. Bonds3

About N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide

N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide (PubChem CID 39139782) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide
PubChem CID39139782
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC NameN-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide
SMILESO=C(Nc1cccc(N2CCOC2=O)c1)C1CCCCC1
InChIInChI=1S/C16H20N2O3/c19-15(12-5-2-1-3-6-12)17-13-7-4-8-14(11-13)18-9-10-21-16(18)20/h4,7-8,11-12H,1-3,5-6,9-10H2,(H,17,19)
InChIKeyMHTNOVLQJJXMJF-UHFFFAOYSA-N
XLogP3.16
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide?
The IUPAC name of N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide (CID 39139782) is N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide?
The canonical SMILES for N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide is O=C(Nc1cccc(N2CCOC2=O)c1)C1CCCCC1.
What is the InChIKey of N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide?
The InChIKey is MHTNOVLQJJXMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c19-15(12-5-2-1-3-6-12)17-13-7-4-8-14(11-13)18-9-10-21-16(18)20/h4,7-8,11-12H,1-3,5-6,9-10H2,(H,17,19).
What are the key properties of N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide?
N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide has a molecular weight of 288.35 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]cyclohexanecarboxamide is sourced from PubChem (CID 39139782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).