N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide

C17H15F2NO2 — CID 171674177

IUPACN-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)cc1F)NC1CCc2c(F)cccc21
InChIInChI=1S/C17H15F2NO2/c18-14-3-1-2-13-12(14)6-7-16(13)20-17(22)8-10-4-5-11(21)9-15(10)19/h1-5,9,16,21H,6-8H2,(H,20,22)
InChIKeyXOASSRYSQIBPPN-UHFFFAOYSA-N
MW303.31 g/mol
LogP3.02
Rot. Bonds3

About N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide

N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide (PubChem CID 171674177) has the molecular formula C17H15F2NO2 and a molecular weight of 303.31 g/mol. Its IUPAC name is N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide
PubChem CID171674177
Molecular FormulaC17H15F2NO2
Molecular Weight303.31 g/mol
Exact Mass303.11
IUPAC NameN-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)cc1F)NC1CCc2c(F)cccc21
InChIInChI=1S/C17H15F2NO2/c18-14-3-1-2-13-12(14)6-7-16(13)20-17(22)8-10-4-5-11(21)9-15(10)19/h1-5,9,16,21H,6-8H2,(H,20,22)
InChIKeyXOASSRYSQIBPPN-UHFFFAOYSA-N
XLogP3.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.31
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2,4-dimethylphenyl)methyl]-3-(4-fluoro-2,3-dihydro-1H-inden-1-yl)urea
CID 86838353
2-[(4-bromo-2-fluorophenyl)methylsulfanyl]-N-(4-hydroxy-2,3-dihydro-1H-inden-1-yl)acetamide
CID 86937510
2-(4-chloro-2-fluorophenyl)-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 100671726
2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120975454
(2R)-2-amino-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)propanamide
CID 119302149
N-[(2R)-4-[[(1S)-4-fluoro-2,3-dihydro-1H-inden-1-yl]amino]-4-oxobutan-2-yl]cyclopentanecarboxamide
CID 95771818
2,6-difluoro-N-[(1S)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]benzamide
CID 95934372
2-(butylsulfonylamino)-N-[(1R)-4-fluoro-2,3-dihydro-1H-inden-1-yl]acetamide
CID 97101391
4-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]-3-nitrophenol
CID 83065641
N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide
CID 47380307
1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(2-methylcyclohexyl)urea
CID 86838302
3-ethylsulfonyl-N-[(1S)-4-fluoro-2,3-dihydro-1H-inden-1-yl]benzamide
CID 97248736

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide?
The IUPAC name of N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide (CID 171674177) is N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide?
The canonical SMILES for N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide is O=C(Cc1ccc(O)cc1F)NC1CCc2c(F)cccc21.
What is the InChIKey of N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide?
The InChIKey is XOASSRYSQIBPPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2NO2/c18-14-3-1-2-13-12(14)6-7-16(13)20-17(22)8-10-4-5-11(21)9-15(10)19/h1-5,9,16,21H,6-8H2,(H,20,22).
What are the key properties of N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide?
N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide has a molecular weight of 303.31 g/mol, XLogP of 3.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-fluoro-4-hydroxyphenyl)acetamide is sourced from PubChem (CID 171674177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).