N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide

C16H16N2O3S — CID 110707115

IUPACN-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide
SMILESO=C(NCCN1CC(c2ccccc2)OC1=O)c1cccs1
InChIInChI=1S/C16H16N2O3S/c19-15(14-7-4-10-22-14)17-8-9-18-11-13(21-16(18)20)12-5-2-1-3-6-12/h1-7,10,13H,8-9,11H2,(H,17,19)
InChIKeySIHLSSSYBFEJQK-UHFFFAOYSA-N
MW316.38 g/mol
LogP2.67
Rot. Bonds5

About N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide

N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide (PubChem CID 110707115) has the molecular formula C16H16N2O3S and a molecular weight of 316.38 g/mol. Its IUPAC name is N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide
PubChem CID110707115
Molecular FormulaC16H16N2O3S
Molecular Weight316.38 g/mol
Exact Mass316.09
IUPAC NameN-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide
SMILESO=C(NCCN1CC(c2ccccc2)OC1=O)c1cccs1
InChIInChI=1S/C16H16N2O3S/c19-15(14-7-4-10-22-14)17-8-9-18-11-13(21-16(18)20)12-5-2-1-3-6-12/h1-7,10,13H,8-9,11H2,(H,17,19)
InChIKeySIHLSSSYBFEJQK-UHFFFAOYSA-N
XLogP2.67
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]pyridine-4-carboxamide
CID 110707136
N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]butanamide
CID 110707104
6-oxo-N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 110741013
N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride
CID 2952427
N-[2-(benzylamino)ethyl]thiophene-2-carboxamide
CID 47148638
N-benzylthiophene-2-carboxamide
CID 574227
N-[(3R)-3-(furan-2-yl)-3-phenylpropyl]thiophene-2-carboxamide
CID 940351
N-[2-(2,3-dioxo-4H-quinoxalin-1-yl)ethyl]thiophene-2-carboxamide
CID 110396405
N-(2-aminoethyl)thiophene-2-carboxamide
CID 4649097
N-(3-amino-3-phenylpropyl)thiophene-2-carboxamide
CID 80506792
4-(thiophene-2-carbonylamino)butanoic acid
CID 3149370
N-(2-cyanoethyl)thiophene-2-carboxamide
CID 60656092

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide (CID 110707115) is N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide is O=C(NCCN1CC(c2ccccc2)OC1=O)c1cccs1.
What is the InChIKey of N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide?
The InChIKey is SIHLSSSYBFEJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3S/c19-15(14-7-4-10-22-14)17-8-9-18-11-13(21-16(18)20)12-5-2-1-3-6-12/h1-7,10,13H,8-9,11H2,(H,17,19).
What are the key properties of N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide?
N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide has a molecular weight of 316.38 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-5-phenyl-1,3-oxazolidin-3-yl)ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 110707115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).