N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide

C18H20F2N2O2 — CID 71915630

IUPACN-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide
SMILESCC(Cc1ccc(O)cc1)N(C)CC(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C18H20F2N2O2/c1-12(9-13-3-6-15(23)7-4-13)22(2)11-18(24)21-17-8-5-14(19)10-16(17)20/h3-8,10,12,23H,9,11H2,1-2H3,(H,21,24)
InChIKeyXGWUGBBAKXXPCG-UHFFFAOYSA-N
MW334.37 g/mol
LogP3.17
Rot. Bonds6

About N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide

N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide (PubChem CID 71915630) has the molecular formula C18H20F2N2O2 and a molecular weight of 334.37 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide
PubChem CID71915630
Molecular FormulaC18H20F2N2O2
Molecular Weight334.37 g/mol
Exact Mass334.15
IUPAC NameN-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide
SMILESCC(Cc1ccc(O)cc1)N(C)CC(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C18H20F2N2O2/c1-12(9-13-3-6-15(23)7-4-13)22(2)11-18(24)21-17-8-5-14(19)10-16(17)20/h3-8,10,12,23H,9,11H2,1-2H3,(H,21,24)
InChIKeyXGWUGBBAKXXPCG-UHFFFAOYSA-N
XLogP3.17
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.37
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-acetyl-4-ethylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113169375
2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide
CID 80505706
2-[[2-(2,4-difluoroanilino)-2-oxoethyl]-methylamino]-N-(4-fluorophenyl)acetamide
CID 9253283
2-[acetyl-[(4-fluorophenyl)methyl]amino]-N-(2,4-difluorophenyl)acetamide
CID 113162490
N-(4-chlorophenyl)-2-[[2-(2,4-difluoroanilino)-2-oxoethyl]-methylamino]acetamide
CID 4818872
2-[[2-(4-chloro-2-fluoroanilino)-2-oxoethyl]-methylamino]propanoic acid
CID 62638871
2-[[2-(2,4-difluoroanilino)-2-oxoethyl]-methylamino]-N-propylacetamide
CID 9302840
2-(N-acetyl-2,4-difluoroanilino)-N-(2,4-difluorophenyl)acetamide
CID 113179083
N-(2,4-difluorophenyl)-2-[methyl(prop-2-ynyl)amino]acetamide
CID 99835722
2-[acetyl(3-methylbutyl)amino]-N-(2,4-difluorophenyl)acetamide
CID 113166624
N-(2,4-difluorophenyl)-N'-(4-hydroxyphenyl)-N'-methyloxamide
CID 108528497
4-(2,4-difluoroanilino)-2-methyl-4-oxobutanoic acid
CID 115164947

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide (CID 71915630) is N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide is CC(Cc1ccc(O)cc1)N(C)CC(=O)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide?
The InChIKey is XGWUGBBAKXXPCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F2N2O2/c1-12(9-13-3-6-15(23)7-4-13)22(2)11-18(24)21-17-8-5-14(19)10-16(17)20/h3-8,10,12,23H,9,11H2,1-2H3,(H,21,24).
What are the key properties of N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide?
N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide has a molecular weight of 334.37 g/mol, XLogP of 3.17, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide is sourced from PubChem (CID 71915630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).