N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide

C19H23N3O3 — CID 54822822

IUPACN-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide
SMILESCCCOc1ccc(NCC(=O)Nc2cccc(NC(C)=O)c2)cc1
InChIInChI=1S/C19H23N3O3/c1-3-11-25-18-9-7-15(8-10-18)20-13-19(24)22-17-6-4-5-16(12-17)21-14(2)23/h4-10,12,20H,3,11,13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyLPOINWOWGINCLK-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.48
Rot. Bonds8

About N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide

N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide (PubChem CID 54822822) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide
PubChem CID54822822
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide
SMILESCCCOc1ccc(NCC(=O)Nc2cccc(NC(C)=O)c2)cc1
InChIInChI=1S/C19H23N3O3/c1-3-11-25-18-9-7-15(8-10-18)20-13-19(24)22-17-6-4-5-16(12-17)21-14(2)23/h4-10,12,20H,3,11,13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyLPOINWOWGINCLK-UHFFFAOYSA-N
XLogP3.48
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide 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-acetamidophenyl)-2-[4-(2-ethoxyethoxy)anilino]acetamide
CID 54825386
2-(4-butoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54820125
N-[3-(2-methoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820051
2-(4-propoxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54820383
2-[4-(2-methylprop-2-enoxy)anilino]-N-(3-propoxyphenyl)acetamide
CID 54824311
N-(3-acetamidophenyl)-2-(4-methoxyanilino)acetamide
CID 39453688
N-(3-acetamidophenyl)-2-(4-prop-2-enoxyanilino)acetamide
CID 54821414
2-(4-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54821314
2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54830279
N-(3-butoxyphenyl)-2-(4-heptoxyanilino)acetamide
CID 54821837
N-[3-[[2-(3-propoxyanilino)acetyl]amino]phenyl]propanamide
CID 54825188
N-(3-acetamidophenyl)-2-(4-phenoxyanilino)acetamide
CID 54812613

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide (CID 54822822) is N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide is CCCOc1ccc(NCC(=O)Nc2cccc(NC(C)=O)c2)cc1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide?
The InChIKey is LPOINWOWGINCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-3-11-25-18-9-7-15(8-10-18)20-13-19(24)22-17-6-4-5-16(12-17)21-14(2)23/h4-10,12,20H,3,11,13H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide?
N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide has a molecular weight of 341.41 g/mol, XLogP of 3.48, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide is sourced from PubChem (CID 54822822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).