N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide

C29H24N2O4 — CID 56694020

IUPACN-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide
SMILESO=C(COc1ccccc1)N(c1ccccc1)C1C(Oc2ccccc2)C(=O)N1c1ccccc1
InChIInChI=1S/C29H24N2O4/c32-26(21-34-24-17-9-3-10-18-24)30(22-13-5-1-6-14-22)28-27(35-25-19-11-4-12-20-25)29(33)31(28)23-15-7-2-8-16-23/h1-20,27-28H,21H2
InChIKeyPRIXPSVQIVEATF-UHFFFAOYSA-N
MW464.52 g/mol
LogP4.92
Rot. Bonds8

About N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide

N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide (PubChem CID 56694020) has the molecular formula C29H24N2O4 and a molecular weight of 464.52 g/mol. Its IUPAC name is N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide.

Molecular Properties

Compound NameN-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide
PubChem CID56694020
Molecular FormulaC29H24N2O4
Molecular Weight464.52 g/mol
Exact Mass464.17
IUPAC NameN-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide
SMILESO=C(COc1ccccc1)N(c1ccccc1)C1C(Oc2ccccc2)C(=O)N1c1ccccc1
InChIInChI=1S/C29H24N2O4/c32-26(21-34-24-17-9-3-10-18-24)30(22-13-5-1-6-14-22)28-27(35-25-19-11-4-12-20-25)29(33)31(28)23-15-7-2-8-16-23/h1-20,27-28H,21H2
InChIKeyPRIXPSVQIVEATF-UHFFFAOYSA-N
XLogP4.92
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.52
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide?
The IUPAC name of N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide (CID 56694020) is N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide.
What is the SMILES notation for N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide?
The canonical SMILES for N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide is O=C(COc1ccccc1)N(c1ccccc1)C1C(Oc2ccccc2)C(=O)N1c1ccccc1.
What is the InChIKey of N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide?
The InChIKey is PRIXPSVQIVEATF-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24N2O4/c32-26(21-34-24-17-9-3-10-18-24)30(22-13-5-1-6-14-22)28-27(35-25-19-11-4-12-20-25)29(33)31(28)23-15-7-2-8-16-23/h1-20,27-28H,21H2.
What are the key properties of N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide?
N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide has a molecular weight of 464.52 g/mol, XLogP of 4.92, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxo-3-phenoxy-1-phenylazetidin-2-yl)-2-phenoxy-N-phenylacetamide is sourced from PubChem (CID 56694020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).