N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide

C20H24FN3O2 — CID 2264836

IUPACN-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide
SMILESCOc1ccccc1N1CCN(CC(=O)Nc2ccc(C)c(F)c2)CC1
InChIInChI=1S/C20H24FN3O2/c1-15-7-8-16(13-17(15)21)22-20(25)14-23-9-11-24(12-10-23)18-5-3-4-6-19(18)26-2/h3-8,13H,9-12,14H2,1-2H3,(H,22,25)
InChIKeyGPELQCWIPUTPAP-UHFFFAOYSA-N
MW357.43 g/mol
LogP2.90
Rot. Bonds5

About N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide

N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide (PubChem CID 2264836) has the molecular formula C20H24FN3O2 and a molecular weight of 357.43 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide
PubChem CID2264836
Molecular FormulaC20H24FN3O2
Molecular Weight357.43 g/mol
Exact Mass357.19
IUPAC NameN-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide
SMILESCOc1ccccc1N1CCN(CC(=O)Nc2ccc(C)c(F)c2)CC1
InChIInChI=1S/C20H24FN3O2/c1-15-7-8-16(13-17(15)21)22-20(25)14-23-9-11-24(12-10-23)18-5-3-4-6-19(18)26-2/h3-8,13H,9-12,14H2,1-2H3,(H,22,25)
InChIKeyGPELQCWIPUTPAP-UHFFFAOYSA-N
XLogP2.90
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2',2''-Dimethoxy-4',4''-biacetanilide
CID 54986
N-(1,1-Dimethylethyl)-4-(2-methoxyphenyl)-alpha-phenyl-1-piperazinepropanamide
CID 115111
2-Ethoxy-2'-ethyloxanilide
CID 90303
Anisopirol
CID 13333
LR 511
CID 68696
(2S)-N-tert-butyl-3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-phenylpropanamide
CID 6604840
1-(2-(Benzyloxy)phenyl)piperazine
CID 22615724
Piperazine, 1-(2-methoxyphenyl)-4-(2-phenylethyl)-
CID 3826471
Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-
CID 55421
2-(4-methylpiperazino)-N-(2-phenoxyphenyl)acetamide
CID 2813152
N-(4-methylphenyl)-2-[methyl-[2-(2-phenylphenoxy)acetyl]amino]acetamide
CID 4790602
2-Methoxyfentanyl
CID 12741853

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide (CID 2264836) is N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide is COc1ccccc1N1CCN(CC(=O)Nc2ccc(C)c(F)c2)CC1.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The InChIKey is GPELQCWIPUTPAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FN3O2/c1-15-7-8-16(13-17(15)21)22-20(25)14-23-9-11-24(12-10-23)18-5-3-4-6-19(18)26-2/h3-8,13H,9-12,14H2,1-2H3,(H,22,25).
What are the key properties of N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide?
N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide has a molecular weight of 357.43 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 2264836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).