N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide

C22H20FNO2 — CID 24571190

IUPACN-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cccc(F)c2)cc1Cc1ccccc1
InChIInChI=1S/C22H20FNO2/c1-26-21-11-10-20(15-18(21)12-16-6-3-2-4-7-16)24-22(25)14-17-8-5-9-19(23)13-17/h2-11,13,15H,12,14H2,1H3,(H,24,25)
InChIKeyJJNAAKCOQCMZHJ-UHFFFAOYSA-N
MW349.41 g/mol
LogP4.61
Rot. Bonds6

About N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide

N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide (PubChem CID 24571190) has the molecular formula C22H20FNO2 and a molecular weight of 349.41 g/mol. Its IUPAC name is N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide
PubChem CID24571190
Molecular FormulaC22H20FNO2
Molecular Weight349.41 g/mol
Exact Mass349.15
IUPAC NameN-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cccc(F)c2)cc1Cc1ccccc1
InChIInChI=1S/C22H20FNO2/c1-26-21-11-10-20(15-18(21)12-16-6-3-2-4-7-16)24-22(25)14-17-8-5-9-19(23)13-17/h2-11,13,15H,12,14H2,1H3,(H,24,25)
InChIKeyJJNAAKCOQCMZHJ-UHFFFAOYSA-N
XLogP4.61
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-benzyl-4-(difluoromethoxy)phenyl]-2-(3-fluorophenyl)acetamide
CID 18288051
N-(3-benzyl-4-methoxyphenyl)-2-(4-methoxyphenyl)acetamide
CID 27038651
N-(3-benzyl-4-methoxyphenyl)pentanamide
CID 18128166
4-amino-N-(3-benzyl-4-methoxyphenyl)butanamide
CID 119274895
3-fluoro-N-[5-[[2-(3-fluorophenyl)acetyl]amino]-2-methoxyphenyl]benzamide
CID 55725735
2-(3-fluorophenyl)-N-[4-methoxy-3-(4-methoxyphenyl)phenyl]acetamide
CID 8745498
N-(5-fluoro-2-methoxyphenyl)-2-(3-fluorophenyl)acetamide
CID 110776591
N-(3,4-dimethylphenyl)-2-(3-fluorophenyl)acetamide
CID 8743428
N-[4-(ethylsulfonylamino)-3-methoxyphenyl]-2-(3-fluorophenyl)acetamide
CID 55947951
N-(3-benzyl-4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 36591038
N-(3-benzyl-4-methoxyphenyl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 27038879
2-(3-fluorophenyl)-N-[4-(4-methoxyanilino)phenyl]acetamide
CID 112987540

Frequently Asked Questions

What is the IUPAC name of N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide?
The IUPAC name of N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide (CID 24571190) is N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide.
What is the SMILES notation for N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide?
The canonical SMILES for N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide is COc1ccc(NC(=O)Cc2cccc(F)c2)cc1Cc1ccccc1.
What is the InChIKey of N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide?
The InChIKey is JJNAAKCOQCMZHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FNO2/c1-26-21-11-10-20(15-18(21)12-16-6-3-2-4-7-16)24-22(25)14-17-8-5-9-19(23)13-17/h2-11,13,15H,12,14H2,1H3,(H,24,25).
What are the key properties of N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide?
N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide has a molecular weight of 349.41 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzyl-4-methoxyphenyl)-2-(3-fluorophenyl)acetamide is sourced from PubChem (CID 24571190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).