5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one

C19H20N2O2 — CID 90656166

IUPAC5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one
SMILESO=C1OC(c2ccccc2)CN1c1ccc2c(c1)CCNCC2
InChIInChI=1S/C19H20N2O2/c22-19-21(13-18(23-19)15-4-2-1-3-5-15)17-7-6-14-8-10-20-11-9-16(14)12-17/h1-7,12,18,20H,8-11,13H2
InChIKeyRFXDLSNNXKJDNP-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.07
Rot. Bonds2

About 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one

5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one (PubChem CID 90656166) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one
PubChem CID90656166
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one
SMILESO=C1OC(c2ccccc2)CN1c1ccc2c(c1)CCNCC2
InChIInChI=1S/C19H20N2O2/c22-19-21(13-18(23-19)15-4-2-1-3-5-15)17-7-6-14-8-10-20-11-9-16(14)12-17/h1-7,12,18,20H,8-11,13H2
InChIKeyRFXDLSNNXKJDNP-UHFFFAOYSA-N
XLogP3.07
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one?
The IUPAC name of 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one (CID 90656166) is 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one?
The canonical SMILES for 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one is O=C1OC(c2ccccc2)CN1c1ccc2c(c1)CCNCC2.
What is the InChIKey of 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one?
The InChIKey is RFXDLSNNXKJDNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-19-21(13-18(23-19)15-4-2-1-3-5-15)17-7-6-14-8-10-20-11-9-16(14)12-17/h1-7,12,18,20H,8-11,13H2.
What are the key properties of 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one?
5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one has a molecular weight of 308.38 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 90656166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).