2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide

C16H16ClNO2 — CID 7642625

IUPAC2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide
SMILESCCc1cc(OCC(=O)Nc2ccccc2)ccc1Cl
InChIInChI=1S/C16H16ClNO2/c1-2-12-10-14(8-9-15(12)17)20-11-16(19)18-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyXQJQULPOYVWWCB-UHFFFAOYSA-N
MW289.76 g/mol
LogP3.92
Rot. Bonds5

About 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide

2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide (PubChem CID 7642625) has the molecular formula C16H16ClNO2 and a molecular weight of 289.76 g/mol. Its IUPAC name is 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide.

Molecular Properties

Compound Name2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide
PubChem CID7642625
Molecular FormulaC16H16ClNO2
Molecular Weight289.76 g/mol
Exact Mass289.09
IUPAC Name2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide
SMILESCCc1cc(OCC(=O)Nc2ccccc2)ccc1Cl
InChIInChI=1S/C16H16ClNO2/c1-2-12-10-14(8-9-15(12)17)20-11-16(19)18-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyXQJQULPOYVWWCB-UHFFFAOYSA-N
XLogP3.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.76
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide
CID 7917215
2-(4-chloro-3-ethylphenoxy)-N-(2-methylphenyl)acetamide
CID 18074792
N-benzyl-2-(4-chloro-3-ethylphenoxy)acetamide
CID 7642627
2-(4-chloro-3-ethylphenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 7642640
2-(4-chloro-3-ethylphenoxy)-N-propan-2-ylacetamide
CID 84602074
2-(4-chloro-3-ethylphenoxy)-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 16545130
1-(4-chloro-3-ethylphenoxy)-3-phenylpropan-2-one
CID 62032160
2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide
CID 7642630
(2-anilino-2-oxoethyl) 2-(4-chloro-3-methylphenoxy)acetate
CID 1409589
2-(4-chloro-3-methylphenoxy)-N-(4-ethylphenyl)acetamide
CID 841196
2-(4-chloro-3,5-dimethylphenoxy)-N-phenylacetamide
CID 918181
2-[4-[[2-(3,4-dichlorophenoxy)acetyl]amino]phenyl]-N-propan-2-ylacetamide
CID 39683774

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide?
The IUPAC name of 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide (CID 7642625) is 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide.
What is the SMILES notation for 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide?
The canonical SMILES for 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide is CCc1cc(OCC(=O)Nc2ccccc2)ccc1Cl.
What is the InChIKey of 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide?
The InChIKey is XQJQULPOYVWWCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO2/c1-2-12-10-14(8-9-15(12)17)20-11-16(19)18-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,18,19).
What are the key properties of 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide?
2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide has a molecular weight of 289.76 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide is sourced from PubChem (CID 7642625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).