N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide

C25H25N3O5 — CID 56573020

IUPACN-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide
SMILESNC(=O)CCNC(=O)c1ccccc1NC(=O)COc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C25H25N3O5/c26-23(29)14-15-27-25(31)21-8-4-5-9-22(21)28-24(30)17-33-20-12-10-19(11-13-20)32-16-18-6-2-1-3-7-18/h1-13H,14-17H2,(H2,26,29)(H,27,31)(H,28,30)
InChIKeyDZWHQKJDPXETQV-UHFFFAOYSA-N
MW447.49 g/mol
LogP2.89
Rot. Bonds11

About N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide

N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide (PubChem CID 56573020) has the molecular formula C25H25N3O5 and a molecular weight of 447.49 g/mol. Its IUPAC name is N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide
PubChem CID56573020
Molecular FormulaC25H25N3O5
Molecular Weight447.49 g/mol
Exact Mass447.18
IUPAC NameN-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide
SMILESNC(=O)CCNC(=O)c1ccccc1NC(=O)COc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C25H25N3O5/c26-23(29)14-15-27-25(31)21-8-4-5-9-22(21)28-24(30)17-33-20-12-10-19(11-13-20)32-16-18-6-2-1-3-7-18/h1-13H,14-17H2,(H2,26,29)(H,27,31)(H,28,30)
InChIKeyDZWHQKJDPXETQV-UHFFFAOYSA-N
XLogP2.89
TPSA119.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.49
LogP ≤ 52.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]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

N-(3-amino-3-oxopropyl)-2-[(4-phenylmethoxybenzoyl)amino]benzamide
CID 56573149
2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(2-phenylethyl)benzamide
CID 29446930
N-(3-amino-3-oxopropyl)-2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]benzamide
CID 56573237
N-[2-(hydrazinecarbonyl)phenyl]-2-phenoxyacetamide
CID 10613129
2-[[(E)-3-[4-(2-amino-2-oxoethoxy)phenyl]prop-2-enoyl]amino]-N-(3-amino-3-oxopropyl)benzamide
CID 56572105
N-(3-amino-3-oxopropyl)-2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]benzamide
CID 56516276
2-[[2-(4-bromophenoxy)acetyl]amino]-N-propylbenzamide
CID 4945967
N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide
CID 17149354
2-[[2-(4-methylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 52891720
N-(3-ethoxypropyl)-2-[(2-phenoxyacetyl)amino]benzamide
CID 17311898
N-(2-methylpropyl)-2-[(2-phenoxyacetyl)amino]benzamide
CID 18089922
N-carbamoyl-2-(4-phenylmethoxyphenoxy)acetamide
CID 7950498

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide?
The IUPAC name of N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide (CID 56573020) is N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide.
What is the SMILES notation for N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide?
The canonical SMILES for N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide is NC(=O)CCNC(=O)c1ccccc1NC(=O)COc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide?
The InChIKey is DZWHQKJDPXETQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O5/c26-23(29)14-15-27-25(31)21-8-4-5-9-22(21)28-24(30)17-33-20-12-10-19(11-13-20)32-16-18-6-2-1-3-7-18/h1-13H,14-17H2,(H2,26,29)(H,27,31)(H,28,30).
What are the key properties of N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide?
N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide has a molecular weight of 447.49 g/mol, XLogP of 2.89, 11 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide is sourced from PubChem (CID 56573020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).