2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide

C15H14ClNO2 — CID 82108856

IUPAC2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(COc2ccccc2)cc1
InChIInChI=1S/C15H14ClNO2/c16-10-15(18)17-13-8-6-12(7-9-13)11-19-14-4-2-1-3-5-14/h1-9H,10-11H2,(H,17,18)
InChIKeyFDKWSPHAKODLHM-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.44
Rot. Bonds5

About 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide

2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide (PubChem CID 82108856) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide
PubChem CID82108856
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(COc2ccccc2)cc1
InChIInChI=1S/C15H14ClNO2/c16-10-15(18)17-13-8-6-12(7-9-13)11-19-14-4-2-1-3-5-14/h1-9H,10-11H2,(H,17,18)
InChIKeyFDKWSPHAKODLHM-UHFFFAOYSA-N
XLogP3.44
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(phenoxymethyl)phenyl]benzamide
CID 141092226
2-(4-bromophenyl)-N-(4-phenylmethoxyphenyl)acetamide
CID 1343788
3-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)propanamide
CID 19220831
methyl 3-oxo-3-(4-phenylmethoxyanilino)propanoate
CID 28638020
N-[4-(2-chloroethyl)phenyl]-2-phenoxyacetamide
CID 114299206
3-(2-hydroxyethylamino)-N-(4-phenylmethoxyphenyl)propanamide
CID 143395384
2,2,2-trichloro-N-(4-phenylmethoxyphenyl)acetamide
CID 884766
1-(2-phenoxyethyl)-3-(4-phenylmethoxyphenyl)urea
CID 112969756
N-(4-ethylphenyl)-4-(phenoxymethyl)benzamide
CID 2195613
[4-oxo-4-(4-phenylmethoxyanilino)butyl]azanium
CID 42149432
3-(4-fluoroanilino)-N-(4-phenylmethoxyphenyl)propanamide
CID 109037756
N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide
CID 109007233

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide?
The IUPAC name of 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide (CID 82108856) is 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide.
What is the SMILES notation for 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide?
The canonical SMILES for 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide is O=C(CCl)Nc1ccc(COc2ccccc2)cc1.
What is the InChIKey of 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide?
The InChIKey is FDKWSPHAKODLHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c16-10-15(18)17-13-8-6-12(7-9-13)11-19-14-4-2-1-3-5-14/h1-9H,10-11H2,(H,17,18).
What are the key properties of 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide?
2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide has a molecular weight of 275.74 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide is sourced from PubChem (CID 82108856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).