4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide

C18H20N2O3 — CID 110761803

IUPAC4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide
SMILESCC(C)(C)Oc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C18H20N2O3/c1-18(2,3)23-15-10-6-13(7-11-15)17(22)20-14-8-4-12(5-9-14)16(19)21/h4-11H,1-3H3,(H2,19,21)(H,20,22)
InChIKeyADFXKCXPCYKZCG-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.22
Rot. Bonds4

About 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide

4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide (PubChem CID 110761803) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide.

Molecular Properties

Compound Name4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide
PubChem CID110761803
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide
SMILESCC(C)(C)Oc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C18H20N2O3/c1-18(2,3)23-15-10-6-13(7-11-15)17(22)20-14-8-4-12(5-9-14)16(19)21/h4-11H,1-3H3,(H2,19,21)(H,20,22)
InChIKeyADFXKCXPCYKZCG-UHFFFAOYSA-N
XLogP3.22
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide with MolForge

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

Launch Full Analysis

Related Compounds

4-tert-butyl-N-(4-carbamoylphenyl)benzamide
CID 3252757
1-N,4-N-bis(4-carbamoylphenyl)benzene-1,4-dicarboxamide
CID 1272826
4-N-(4-acetamidophenyl)benzene-1,4-dicarboxamide
CID 27648779
methyl 4-[(4-carbamoylbenzoyl)amino]benzoate
CID 30845691
methyl 4-[(4-carbamoylphenyl)carbamoyl]benzoate
CID 5085217
2-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide
CID 110761802
3-acetamido-N-[4-[(2-methylpropan-2-yl)oxy]phenyl]benzamide
CID 110792701
4-[[4-(difluoromethoxy)benzoyl]amino]benzamide
CID 842852
4-[[4-(2-methylpropoxy)benzoyl]amino]benzamide
CID 2994766
4-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]benzamide
CID 888392
4-[4-[[4-(2-methoxyethoxy)phenyl]carbamoyl]phenoxy]benzamide
CID 56545946
methyl N-[4-[(2-methylpropan-2-yl)oxy]phenyl]carbamate
CID 67274992

Frequently Asked Questions

What is the IUPAC name of 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide?
The IUPAC name of 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide (CID 110761803) is 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide.
What is the SMILES notation for 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide?
The canonical SMILES for 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide is CC(C)(C)Oc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1.
What is the InChIKey of 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide?
The InChIKey is ADFXKCXPCYKZCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-18(2,3)23-15-10-6-13(7-11-15)17(22)20-14-8-4-12(5-9-14)16(19)21/h4-11H,1-3H3,(H2,19,21)(H,20,22).
What are the key properties of 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide?
4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide has a molecular weight of 312.37 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide is sourced from PubChem (CID 110761803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).