2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide

C22H27NO3 — CID 55759227

IUPAC2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
SMILESO=C(COCCOc1ccccc1)NCC1(c2ccccc2)CCCC1
InChIInChI=1S/C22H27NO3/c24-21(17-25-15-16-26-20-11-5-2-6-12-20)23-18-22(13-7-8-14-22)19-9-3-1-4-10-19/h1-6,9-12H,7-8,13-18H2,(H,23,24)
InChIKeyJZHMRDWHQYMQME-UHFFFAOYSA-N
MW353.46 g/mol
LogP3.71
Rot. Bonds9

About 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide

2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide (PubChem CID 55759227) has the molecular formula C22H27NO3 and a molecular weight of 353.46 g/mol. Its IUPAC name is 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
PubChem CID55759227
Molecular FormulaC22H27NO3
Molecular Weight353.46 g/mol
Exact Mass353.20
IUPAC Name2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
SMILESO=C(COCCOc1ccccc1)NCC1(c2ccccc2)CCCC1
InChIInChI=1S/C22H27NO3/c24-21(17-25-15-16-26-20-11-5-2-6-12-20)23-18-22(13-7-8-14-22)19-9-3-1-4-10-19/h1-6,9-12H,7-8,13-18H2,(H,23,24)
InChIKeyJZHMRDWHQYMQME-UHFFFAOYSA-N
XLogP3.71
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.46
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]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

2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide
CID 17437937
2-(2-methoxyphenoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 18128274
N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide
CID 47045190
3-methoxy-N-[(1-phenylcyclopentyl)methyl]propanamide
CID 110480493
N-(2-hydroxyethyl)-2-(2-phenoxyethoxy)acetamide
CID 78883192
2-(1,3-benzodioxol-5-yloxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 171132856
methyl 4-[2-oxo-2-[(1-phenylcyclopropyl)methylamino]ethoxy]benzoate
CID 134038073
2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 110459326
2-[4-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenoxy]-N-[(1-phenylcyclohexyl)methyl]acetamide
CID 166355790
3-amino-N-[(1-phenylcyclobutyl)methyl]propanamide
CID 110460227
2-(2-methoxyethylamino)-N-[(1-phenylcyclopentyl)methyl]acetamide;hydrochloride
CID 119698187
N-[[1-(hydroxymethyl)cyclohexyl]methyl]-3-phenoxypropanamide
CID 110292567

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide?
The IUPAC name of 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide (CID 55759227) is 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide.
What is the SMILES notation for 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide?
The canonical SMILES for 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide is O=C(COCCOc1ccccc1)NCC1(c2ccccc2)CCCC1.
What is the InChIKey of 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide?
The InChIKey is JZHMRDWHQYMQME-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO3/c24-21(17-25-15-16-26-20-11-5-2-6-12-20)23-18-22(13-7-8-14-22)19-9-3-1-4-10-19/h1-6,9-12H,7-8,13-18H2,(H,23,24).
What are the key properties of 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide?
2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide has a molecular weight of 353.46 g/mol, XLogP of 3.71, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxyethoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide is sourced from PubChem (CID 55759227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).