N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide

C16H15F2NO2 — CID 110782201

IUPACN-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)NCc2ccc(F)cc2F)cc1
InChIInChI=1S/C16H15F2NO2/c1-21-14-6-2-11(3-7-14)8-16(20)19-10-12-4-5-13(17)9-15(12)18/h2-7,9H,8,10H2,1H3,(H,19,20)
InChIKeyMJUQJBGBFWGRMB-UHFFFAOYSA-N
MW291.30 g/mol
LogP2.83
Rot. Bonds5

About N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide

N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide (PubChem CID 110782201) has the molecular formula C16H15F2NO2 and a molecular weight of 291.30 g/mol. Its IUPAC name is N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide
PubChem CID110782201
Molecular FormulaC16H15F2NO2
Molecular Weight291.30 g/mol
Exact Mass291.11
IUPAC NameN-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)NCc2ccc(F)cc2F)cc1
InChIInChI=1S/C16H15F2NO2/c1-21-14-6-2-11(3-7-14)8-16(20)19-10-12-4-5-13(17)9-15(12)18/h2-7,9H,8,10H2,1H3,(H,19,20)
InChIKeyMJUQJBGBFWGRMB-UHFFFAOYSA-N
XLogP2.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,4-difluorophenyl)methyl]-3,5-dimethoxybenzamide
CID 110782194
N-[2-[[2-(4-fluorophenyl)acetyl]amino]ethyl]-2-(4-methoxyphenyl)acetamide
CID 108538633
N-[(2,4-difluorophenyl)methyl]-1-[2-(4-methoxyphenyl)acetyl]-4-methylpiperidine-4-carboxamide
CID 52999173
butanoic acid;2-(2,4-difluorophenyl)acetic acid;2-(4-methoxyphenyl)acetic acid
CID 70282538
2-(2,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]acetamide
CID 27256771
N-[[1-[(2,4-difluorophenyl)methyl]piperidin-3-yl]methyl]-2-(4-methoxyphenyl)acetamide
CID 23723823
N-[2-(2,4-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 110789003
N-[(2,3-dimethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 46590636
2,4-difluoro-N-[3-[(6-methoxynaphthalen-2-yl)methylamino]-3-oxopropyl]benzamide
CID 24598993
N-[(2,4-difluorophenyl)methyl]-1-[3-(4-methoxyphenyl)propanoyl]-4-methylpiperidine-4-carboxamide
CID 52999174
N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide
CID 166226019
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide (CID 110782201) is N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide is COc1ccc(CC(=O)NCc2ccc(F)cc2F)cc1.
What is the InChIKey of N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide?
The InChIKey is MJUQJBGBFWGRMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO2/c1-21-14-6-2-11(3-7-14)8-16(20)19-10-12-4-5-13(17)9-15(12)18/h2-7,9H,8,10H2,1H3,(H,19,20).
What are the key properties of N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide?
N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide has a molecular weight of 291.30 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 110782201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).