3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide

C23H20N2O3 — CID 71890191

IUPAC3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide
SMILESO=C(C=Cc1cccc2ccccc12)Nc1ccc(CN2CCOC2=O)cc1
InChIInChI=1S/C23H20N2O3/c26-22(13-10-19-6-3-5-18-4-1-2-7-21(18)19)24-20-11-8-17(9-12-20)16-25-14-15-28-23(25)27/h1-13H,14-16H2,(H,24,26)
InChIKeyYEIUUIJDJNEULE-UHFFFAOYSA-N
MW372.42 g/mol
LogP4.44
Rot. Bonds5

About 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide

3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide (PubChem CID 71890191) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide.

Molecular Properties

Compound Name3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide
PubChem CID71890191
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide
SMILESO=C(C=Cc1cccc2ccccc12)Nc1ccc(CN2CCOC2=O)cc1
InChIInChI=1S/C23H20N2O3/c26-22(13-10-19-6-3-5-18-4-1-2-7-21(18)19)24-20-11-8-17(9-12-20)16-25-14-15-28-23(25)27/h1-13H,14-16H2,(H,24,26)
InChIKeyYEIUUIJDJNEULE-UHFFFAOYSA-N
XLogP4.44
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

3-naphthalen-1-yl-N-(4-phenyldiazenylphenyl)prop-2-enamide
CID 5177921
(E)-N-(4-hydroxyphenyl)-3-naphthalen-1-ylprop-2-enamide
CID 102534918
N-(4-methoxyphenyl)-3-naphthalen-1-ylprop-2-enamide
CID 680988
(Z)-N-(3-chloro-4-methylphenyl)-3-naphthalen-1-ylprop-2-enamide
CID 92949912
(E)-N-(3-chloro-4-methylphenyl)-3-naphthalen-1-ylprop-2-enamide
CID 6239949
3-naphthalen-1-yl-N-[2-(3-naphthalen-1-ylprop-2-enoylamino)phenyl]prop-2-enamide
CID 4233655
3-(2,5-dioxoimidazolidin-1-yl)-N-[4-(3-naphthalen-1-ylprop-2-enoylamino)phenyl]propanamide
CID 55732487
(E)-N-(3-morpholin-4-ylsulfonylphenyl)-3-naphthalen-1-ylprop-2-enamide
CID 17371690
(E)-N-[3-(methylcarbamoylamino)phenyl]-3-naphthalen-1-ylprop-2-enamide
CID 36824939
3-naphthalen-1-yl-N-[4-(phenylsulfamoyl)phenyl]prop-2-enamide
CID 5157349
N-[4-(benzylsulfamoyl)phenyl]-3-naphthalen-1-ylprop-2-enamide
CID 4928932
N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-1-(2-phenylethyl)pyrrole-2-carboxamide
CID 86876348

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide?
The IUPAC name of 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide (CID 71890191) is 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide.
What is the SMILES notation for 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide?
The canonical SMILES for 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide is O=C(C=Cc1cccc2ccccc12)Nc1ccc(CN2CCOC2=O)cc1.
What is the InChIKey of 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide?
The InChIKey is YEIUUIJDJNEULE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c26-22(13-10-19-6-3-5-18-4-1-2-7-21(18)19)24-20-11-8-17(9-12-20)16-25-14-15-28-23(25)27/h1-13H,14-16H2,(H,24,26).
What are the key properties of 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide?
3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide has a molecular weight of 372.42 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-1-yl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]prop-2-enamide is sourced from PubChem (CID 71890191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).