N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide

C18H21ClN2O3 — CID 119738642

IUPACN-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)Nc1ccc(OCc2ccccc2Cl)cc1
InChIInChI=1S/C18H21ClN2O3/c1-23-11-10-20-12-18(22)21-15-6-8-16(9-7-15)24-13-14-4-2-3-5-17(14)19/h2-9,20H,10-13H2,1H3,(H,21,22)
InChIKeyOKXHYLAVQZKDMG-UHFFFAOYSA-N
MW348.83 g/mol
LogP3.09
Rot. Bonds9

About N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide

N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide (PubChem CID 119738642) has the molecular formula C18H21ClN2O3 and a molecular weight of 348.83 g/mol. Its IUPAC name is N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide
PubChem CID119738642
Molecular FormulaC18H21ClN2O3
Molecular Weight348.83 g/mol
Exact Mass348.12
IUPAC NameN-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)Nc1ccc(OCc2ccccc2Cl)cc1
InChIInChI=1S/C18H21ClN2O3/c1-23-11-10-20-12-18(22)21-15-6-8-16(9-7-15)24-13-14-4-2-3-5-17(14)19/h2-9,20H,10-13H2,1H3,(H,21,22)
InChIKeyOKXHYLAVQZKDMG-UHFFFAOYSA-N
XLogP3.09
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.83
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethylamino)-N-(4-methoxyphenyl)acetamide
CID 28565585
4-[[2-[(2-chlorophenyl)methylamino]acetyl]amino]-N-(2-methoxyethyl)benzamide
CID 54832614
4-[(2-chlorophenyl)methoxy]-N-(2-methoxyethyl)benzamide
CID 6462098
2-(2-methoxyethylamino)-N-[4-(2-methylpropoxy)phenyl]acetamide
CID 54819703
N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide
CID 79281170
N-[(2-chlorophenyl)methyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119673533
5-bromo-N-[2-[4-[(2-chlorophenyl)methoxy]anilino]-2-oxoethyl]furan-2-carboxamide
CID 55945410
N-(4-chlorophenyl)-2-[2-(4-methoxyphenoxy)ethylamino]acetamide
CID 109005237
N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide
CID 60647399
4-[(2-chlorophenyl)methoxy]-N-phenylbenzamide
CID 8813243
2-[(2-chlorophenyl)methylamino]-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54832705
2-(2-methoxyethylamino)-N-[4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]acetamide;hydrochloride
CID 119773689

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide (CID 119738642) is N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide is COCCNCC(=O)Nc1ccc(OCc2ccccc2Cl)cc1.
What is the InChIKey of N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide?
The InChIKey is OKXHYLAVQZKDMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O3/c1-23-11-10-20-12-18(22)21-15-6-8-16(9-7-15)24-13-14-4-2-3-5-17(14)19/h2-9,20H,10-13H2,1H3,(H,21,22).
What are the key properties of N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide?
N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide has a molecular weight of 348.83 g/mol, XLogP of 3.09, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 119738642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).