N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide

C17H18FNO2 — CID 110780202

IUPACN-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide
SMILESCOc1ccc(F)cc1CNC(=O)Cc1cccc(C)c1
InChIInChI=1S/C17H18FNO2/c1-12-4-3-5-13(8-12)9-17(20)19-11-14-10-15(18)6-7-16(14)21-2/h3-8,10H,9,11H2,1-2H3,(H,19,20)
InChIKeyGYWVDFYCZQJISB-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.00
Rot. Bonds5

About N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide

N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide (PubChem CID 110780202) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide
PubChem CID110780202
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC NameN-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide
SMILESCOc1ccc(F)cc1CNC(=O)Cc1cccc(C)c1
InChIInChI=1S/C17H18FNO2/c1-12-4-3-5-13(8-12)9-17(20)19-11-14-10-15(18)6-7-16(14)21-2/h3-8,10H,9,11H2,1-2H3,(H,19,20)
InChIKeyGYWVDFYCZQJISB-UHFFFAOYSA-N
XLogP3.00
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide
CID 110780207
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780208
2-amino-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide
CID 82126824
N-[(3-fluoro-4-methoxyphenyl)methyl]-2-(3-fluorophenyl)acetamide
CID 110780014
2-(5-fluoro-2-methoxyphenyl)-N-(2-phenylethyl)acetamide
CID 110767149
N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
CID 112992570
4-[(5-fluoro-2-methoxyphenyl)methylamino]-4-oxobutanoic acid
CID 94691306
N-[(5-fluoro-2-methoxyphenyl)methyl]-3-methylbutanamide
CID 110780143
3-chloro-N-[(5-fluoro-2-methoxyphenyl)methyl]propanamide
CID 115162483
N-[(2-methoxyphenyl)methyl]-3-[(3-methylphenyl)methylamino]propanamide
CID 109019582
2-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 808183
2-(2-methoxy-5-methylphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 9184395

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide (CID 110780202) is N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide is COc1ccc(F)cc1CNC(=O)Cc1cccc(C)c1.
What is the InChIKey of N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide?
The InChIKey is GYWVDFYCZQJISB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-12-4-3-5-13(8-12)9-17(20)19-11-14-10-15(18)6-7-16(14)21-2/h3-8,10H,9,11H2,1-2H3,(H,19,20).
What are the key properties of N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide?
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide has a molecular weight of 287.33 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 110780202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).