2-(2-chloro-4-phenylphenoxy)-N-methylacetamide

C15H14ClNO2 — CID 17466417

IUPAC2-(2-chloro-4-phenylphenoxy)-N-methylacetamide
SMILESCNC(=O)COc1ccc(-c2ccccc2)cc1Cl
InChIInChI=1S/C15H14ClNO2/c1-17-15(18)10-19-14-8-7-12(9-13(14)16)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,18)
InChIKeyBCYCHNXPVZXSGJ-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.13
Rot. Bonds4

About 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide

2-(2-chloro-4-phenylphenoxy)-N-methylacetamide (PubChem CID 17466417) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide.

Molecular Properties

Compound Name2-(2-chloro-4-phenylphenoxy)-N-methylacetamide
PubChem CID17466417
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name2-(2-chloro-4-phenylphenoxy)-N-methylacetamide
SMILESCNC(=O)COc1ccc(-c2ccccc2)cc1Cl
InChIInChI=1S/C15H14ClNO2/c1-17-15(18)10-19-14-8-7-12(9-13(14)16)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,18)
InChIKeyBCYCHNXPVZXSGJ-UHFFFAOYSA-N
XLogP3.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(methylcarbamoylamino)-2-oxoethyl] 2-(2-chloro-4-phenylphenoxy)acetate
CID 8546642
N-(2-amino-2-methylpropyl)-2-(2-chloro-4-phenylphenoxy)acetamide;hydrochloride
CID 119627165
3-chloro-4-[2-(methylamino)-2-oxoethoxy]benzoic acid
CID 60693388
2-(2-chloro-4-phenylphenoxy)-N-(1-methylpyrazol-3-yl)acetamide
CID 51238001
2-(2-chloro-4-phenylphenoxy)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide
CID 42896247
2-(2-chloro-4-phenylphenoxy)-N-(cyclohexylmethyl)acetamide
CID 7653172
2-(2-chloro-4-phenylphenoxy)-N-(1-pyridin-4-ylethyl)acetamide
CID 24639231
ethyl 2-[[2-(2-chloro-4-phenylphenoxy)acetyl]amino]benzoate
CID 7653195
2-(2-chloro-4-phenylphenoxy)-1-(2,4,5-trimethylphenyl)ethanone
CID 7652853
2-(2-chloro-4-phenylphenoxy)-N-(2-methoxy-5-nitrophenyl)acetamide
CID 7653192
2-(2-chloro-4-phenylphenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide
CID 7949295
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(2-chloro-4-phenylphenoxy)acetamide;hydrochloride
CID 119456429

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide?
The IUPAC name of 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide (CID 17466417) is 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide.
What is the SMILES notation for 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide?
The canonical SMILES for 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide is CNC(=O)COc1ccc(-c2ccccc2)cc1Cl.
What is the InChIKey of 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide?
The InChIKey is BCYCHNXPVZXSGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-17-15(18)10-19-14-8-7-12(9-13(14)16)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide?
2-(2-chloro-4-phenylphenoxy)-N-methylacetamide has a molecular weight of 275.74 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-phenylphenoxy)-N-methylacetamide is sourced from PubChem (CID 17466417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).