2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide

C16H13F2NO2 — CID 62660008

IUPAC2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide
SMILESO=C(NC1c2ccccc2CC1O)c1cccc(F)c1F
InChIInChI=1S/C16H13F2NO2/c17-12-7-3-6-11(14(12)18)16(21)19-15-10-5-2-1-4-9(10)8-13(15)20/h1-7,13,15,20H,8H2,(H,19,21)
InChIKeyIADKSIGLWFJRTI-UHFFFAOYSA-N
MW289.28 g/mol
LogP2.35
Rot. Bonds2

About 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide

2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide (PubChem CID 62660008) has the molecular formula C16H13F2NO2 and a molecular weight of 289.28 g/mol. Its IUPAC name is 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide.

Molecular Properties

Compound Name2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide
PubChem CID62660008
Molecular FormulaC16H13F2NO2
Molecular Weight289.28 g/mol
Exact Mass289.09
IUPAC Name2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide
SMILESO=C(NC1c2ccccc2CC1O)c1cccc(F)c1F
InChIInChI=1S/C16H13F2NO2/c17-12-7-3-6-11(14(12)18)16(21)19-15-10-5-2-1-4-9(10)8-13(15)20/h1-7,13,15,20H,8H2,(H,19,21)
InChIKeyIADKSIGLWFJRTI-UHFFFAOYSA-N
XLogP2.35
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.28
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-3-methylbenzamide
CID 80711787
2,6-difluoro-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]benzamide
CID 103816872
2,3-difluoro-N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pyridine-4-carboxamide
CID 103337662
5-chloro-2-fluoro-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]benzamide
CID 103816845
2-fluoro-4-hydroxy-N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]benzamide
CID 107677059
2-bromo-6-fluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide
CID 115867109
N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2,3-dimethylbenzamide
CID 103816856
4-amino-2-fluoro-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]benzamide
CID 107211343
2-fluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-5-(trifluoromethyl)benzamide
CID 111970090
N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-nitrobenzamide
CID 110906535
2-chloro-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide
CID 103869650
2,4-dibromo-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]benzamide
CID 103883197

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide?
The IUPAC name of 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide (CID 62660008) is 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide.
What is the SMILES notation for 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide?
The canonical SMILES for 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide is O=C(NC1c2ccccc2CC1O)c1cccc(F)c1F.
What is the InChIKey of 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide?
The InChIKey is IADKSIGLWFJRTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F2NO2/c17-12-7-3-6-11(14(12)18)16(21)19-15-10-5-2-1-4-9(10)8-13(15)20/h1-7,13,15,20H,8H2,(H,19,21).
What are the key properties of 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide?
2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide has a molecular weight of 289.28 g/mol, XLogP of 2.35, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)benzamide is sourced from PubChem (CID 62660008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).