4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide

C25H26N4O4 — CID 55840868

IUPAC4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide
SMILESCC(C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2)NC(=O)CNC(=O)C3=CC=C(C=C3)OC
InChIInChI=1S/C25H26N4O4/c1-17(27-23(30)16-26-24(31)19-10-14-22(33-2)15-11-19)18-8-12-21(13-9-18)29-25(32)28-20-6-4-3-5-7-20/h3-15,17H,16H2,1-2H3,(H,26,31)(H,27,30)(H2,28,29,32)
InChIKeyUUNOSIKFVBHONL-UHFFFAOYSA-N
MW446.50 g/mol
LogP3.00
Rot. Bonds8

About 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide

4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide (PubChem CID 55840868) has the molecular formula C25H26N4O4 and a molecular weight of 446.50 g/mol. Its IUPAC name is 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide
PubChem CID55840868
Molecular FormulaC25H26N4O4
Molecular Weight446.50 g/mol
Exact Mass446.20
IUPAC Name4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide
SMILESCC(C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2)NC(=O)CNC(=O)C3=CC=C(C=C3)OC
InChIInChI=1S/C25H26N4O4/c1-17(27-23(30)16-26-24(31)19-10-14-22(33-2)15-11-19)18-8-12-21(13-9-18)29-25(32)28-20-6-4-3-5-7-20/h3-15,17H,16H2,1-2H3,(H,26,31)(H,27,30)(H2,28,29,32)
InChIKeyUUNOSIKFVBHONL-UHFFFAOYSA-N
XLogP3.00
TPSA109.00 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms33
Complexity636

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.50
LogP ≤ 53.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide 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 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide (CID 55840868) is 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide is CC(C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2)NC(=O)CNC(=O)C3=CC=C(C=C3)OC.
What is the InChIKey of 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide?
The InChIKey is UUNOSIKFVBHONL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O4/c1-17(27-23(30)16-26-24(31)19-10-14-22(33-2)15-11-19)18-8-12-21(13-9-18)29-25(32)28-20-6-4-3-5-7-20/h3-15,17H,16H2,1-2H3,(H,26,31)(H,27,30)(H2,28,29,32).
What are the key properties of 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide?
4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide has a molecular weight of 446.50 g/mol, XLogP of 3.00, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]benzamide is sourced from PubChem (CID 55840868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).