2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide

C22H28N2O4 — CID 54829439

IUPAC2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CNc2ccccc2OCC2CCCO2)c1
InChIInChI=1S/C22H28N2O4/c1-2-12-26-18-8-5-7-17(14-18)24-22(25)15-23-20-10-3-4-11-21(20)28-16-19-9-6-13-27-19/h3-5,7-8,10-11,14,19,23H,2,6,9,12-13,15-16H2,1H3,(H,24,25)
InChIKeyUTPBOYNMNTXUSE-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.08
Rot. Bonds10

About 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide

2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide (PubChem CID 54829439) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide
PubChem CID54829439
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CNc2ccccc2OCC2CCCO2)c1
InChIInChI=1S/C22H28N2O4/c1-2-12-26-18-8-5-7-17(14-18)24-22(25)15-23-20-10-3-4-11-21(20)28-16-19-9-6-13-27-19/h3-5,7-8,10-11,14,19,23H,2,6,9,12-13,15-16H2,1H3,(H,24,25)
InChIKeyUTPBOYNMNTXUSE-UHFFFAOYSA-N
XLogP4.08
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)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-(2-methylprop-2-enoxy)phenyl]-2-[2-(oxolan-2-ylmethoxy)anilino]acetamide
CID 54829537
3-[[2-[2-(oxolan-2-ylmethoxy)anilino]acetyl]amino]benzamide
CID 54829835
N-(3-heptoxyphenyl)-2-[3-(oxolan-2-ylmethoxy)anilino]acetamide
CID 54828366
N-(2-ethoxyphenyl)-2-[3-(oxolan-2-ylmethoxy)anilino]acetamide
CID 54828489
3-[[2-[2-(oxolan-2-ylmethoxy)anilino]acetyl]amino]-N-propan-2-ylbenzamide
CID 54829734
N-[3-[[2-[2-(oxolan-2-ylmethoxy)anilino]acetyl]amino]phenyl]-3-phenylpropanamide
CID 54829542
2-(2-ethoxyanilino)-N-[2-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54817509
2-(3-butan-2-yloxyanilino)-N-[2-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54830103
N-[3-(3-methylbutoxy)phenyl]-2-[3-(oxolan-2-ylmethoxy)anilino]acetamide
CID 54828556
N-[4-chloro-3-[[2-[2-(oxolan-2-ylmethoxy)anilino]acetyl]amino]phenyl]butanamide
CID 54829442
2-(ethylamino)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54820938
N-[3-(oxolan-2-ylmethoxy)phenyl]-2-propoxybenzamide
CID 17141891

Frequently Asked Questions

What is the IUPAC name of 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide?
The IUPAC name of 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide (CID 54829439) is 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide.
What is the SMILES notation for 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide?
The canonical SMILES for 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide is CCCOc1cccc(NC(=O)CNc2ccccc2OCC2CCCO2)c1.
What is the InChIKey of 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide?
The InChIKey is UTPBOYNMNTXUSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-2-12-26-18-8-5-7-17(14-18)24-22(25)15-23-20-10-3-4-11-21(20)28-16-19-9-6-13-27-19/h3-5,7-8,10-11,14,19,23H,2,6,9,12-13,15-16H2,1H3,(H,24,25).
What are the key properties of 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide?
2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide has a molecular weight of 384.48 g/mol, XLogP of 4.08, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(oxolan-2-ylmethoxy)anilino]-N-(3-propoxyphenyl)acetamide is sourced from PubChem (CID 54829439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).