2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide

C17H18ClNO3 — CID 110904694

IUPAC2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide
SMILESCOc1ccc(Cl)cc1CC(=O)Nc1ccccc1C(C)O
InChIInChI=1S/C17H18ClNO3/c1-11(20)14-5-3-4-6-15(14)19-17(21)10-12-9-13(18)7-8-16(12)22-2/h3-9,11,20H,10H2,1-2H3,(H,19,21)
InChIKeyXUCXZBOFCVYCIE-UHFFFAOYSA-N
MW319.79 g/mol
LogP3.58
Rot. Bonds5

About 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide

2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide (PubChem CID 110904694) has the molecular formula C17H18ClNO3 and a molecular weight of 319.79 g/mol. Its IUPAC name is 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide
PubChem CID110904694
Molecular FormulaC17H18ClNO3
Molecular Weight319.79 g/mol
Exact Mass319.10
IUPAC Name2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide
SMILESCOc1ccc(Cl)cc1CC(=O)Nc1ccccc1C(C)O
InChIInChI=1S/C17H18ClNO3/c1-11(20)14-5-3-4-6-15(14)19-17(21)10-12-9-13(18)7-8-16(12)22-2/h3-9,11,20H,10H2,1-2H3,(H,19,21)
InChIKeyXUCXZBOFCVYCIE-UHFFFAOYSA-N
XLogP3.58
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-chloro-2-methoxyphenyl)-N-[2-(2-ethylanilino)-2-oxoethyl]acetamide
CID 9090821
2-(5-chloro-2-methoxyphenyl)-N-(2,4-dimethoxyphenyl)acetamide
CID 17423898
2-(2-fluorophenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide
CID 43508486
2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide
CID 8866171
[2-(2-methoxyanilino)-2-oxoethyl] 2-(5-chloro-2-methoxyphenyl)acetate
CID 8615244
(1R)-1-[2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]ethanol
CID 63364799
N-(5-chloro-2-methoxyphenyl)-2-(2-chlorophenyl)acetamide
CID 2666806
2-(1-chloroethyl)-N-[(5-chloro-2-methoxyphenyl)methyl]aniline
CID 65029811
N-(2-butan-2-ylphenyl)-2-(2-methoxyphenyl)acetamide
CID 3725070
2-(4-chlorophenoxy)-N-[2-(1-hydroxyethyl)phenyl]acetamide
CID 60728567
N-(5-chloro-2-methoxyphenyl)-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide
CID 9307080
2-(5-chloro-2-methoxyphenyl)-N-(1,3-dihydroxypropan-2-yl)acetamide
CID 65312632

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide?
The IUPAC name of 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide (CID 110904694) is 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide.
What is the SMILES notation for 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide?
The canonical SMILES for 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide is COc1ccc(Cl)cc1CC(=O)Nc1ccccc1C(C)O.
What is the InChIKey of 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide?
The InChIKey is XUCXZBOFCVYCIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO3/c1-11(20)14-5-3-4-6-15(14)19-17(21)10-12-9-13(18)7-8-16(12)22-2/h3-9,11,20H,10H2,1-2H3,(H,19,21).
What are the key properties of 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide?
2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide has a molecular weight of 319.79 g/mol, XLogP of 3.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methoxyphenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide is sourced from PubChem (CID 110904694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).