N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide

C23H23NO4 — CID 71198512

IUPACN-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide
SMILESCOc1cccc(CN(C(C)=O)c2ccccc2Oc2ccccc2)c1OC
InChIInChI=1S/C23H23NO4/c1-17(25)24(16-18-10-9-15-22(26-2)23(18)27-3)20-13-7-8-14-21(20)28-19-11-5-4-6-12-19/h4-15H,16H2,1-3H3
InChIKeyLXJSVXKFXYLTNZ-UHFFFAOYSA-N
MW377.44 g/mol
LogP5.05
Rot. Bonds7

About N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide

N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide (PubChem CID 71198512) has the molecular formula C23H23NO4 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide
PubChem CID71198512
Molecular FormulaC23H23NO4
Molecular Weight377.44 g/mol
Exact Mass377.16
IUPAC NameN-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide
SMILESCOc1cccc(CN(C(C)=O)c2ccccc2Oc2ccccc2)c1OC
InChIInChI=1S/C23H23NO4/c1-17(25)24(16-18-10-9-15-22(26-2)23(18)27-3)20-13-7-8-14-21(20)28-19-11-5-4-6-12-19/h4-15H,16H2,1-3H3
InChIKeyLXJSVXKFXYLTNZ-UHFFFAOYSA-N
XLogP5.05
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.44
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(111C)methyl 2-[(N-acetyl-2-phenoxyanilino)methyl]benzoate
CID 11624963
1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea
CID 18407217
N-(2-phenoxyphenyl)-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
CID 18407202
N-(5-amino-2-phenoxyphenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
CID 71470709
N-[[2-(fluoromethyl)-5-methoxyphenyl]methyl]-N-(5-fluoro-2-phenoxyphenyl)acetamide
CID 22556111
2-(N-acetyl-2-phenoxyanilino)-N-[(2-fluorophenyl)methyl]acetamide
CID 113179217
2-(N-acetyl-2-phenoxyanilino)-N-phenylacetamide
CID 113179233
N-(5-fluoro-2-phenoxyphenyl)-N-[(5-methoxy-2-phenylmethoxyphenyl)methyl]acetamide
CID 59765851
N-[3-[2-[(N-acetyl-5-fluoro-2-phenoxyanilino)methyl]-4-methoxyanilino]-2,3-dimethylbutan-2-yl]acetamide
CID 71049772
2-(N-acetyl-2-phenoxyanilino)-N-tert-butylacetamide
CID 113179224
N-[(4-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide
CID 75412382
N-[2-(N-acetyl-2-phenoxyanilino)ethyl]benzamide
CID 113063434

Frequently Asked Questions

What is the IUPAC name of N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide?
The IUPAC name of N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide (CID 71198512) is N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide.
What is the SMILES notation for N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide?
The canonical SMILES for N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide is COc1cccc(CN(C(C)=O)c2ccccc2Oc2ccccc2)c1OC.
What is the InChIKey of N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide?
The InChIKey is LXJSVXKFXYLTNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO4/c1-17(25)24(16-18-10-9-15-22(26-2)23(18)27-3)20-13-7-8-14-21(20)28-19-11-5-4-6-12-19/h4-15H,16H2,1-3H3.
What are the key properties of N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide?
N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide has a molecular weight of 377.44 g/mol, XLogP of 5.05, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide is sourced from PubChem (CID 71198512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).