N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide

C17H14FNO2 — CID 134118733

IUPACN-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1)C1Cc2cc(F)ccc2C1=O
InChIInChI=1S/C17H14FNO2/c1-19(17(21)11-5-3-2-4-6-11)15-10-12-9-13(18)7-8-14(12)16(15)20/h2-9,15H,10H2,1H3
InChIKeyZVXLODDMINVWJE-UHFFFAOYSA-N
MW283.30 g/mol
LogP2.71
Rot. Bonds2

About N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide

N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide (PubChem CID 134118733) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide.

Molecular Properties

Compound NameN-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide
PubChem CID134118733
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC NameN-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1)C1Cc2cc(F)ccc2C1=O
InChIInChI=1S/C17H14FNO2/c1-19(17(21)11-5-3-2-4-6-11)15-10-12-9-13(18)7-8-14(12)16(15)20/h2-9,15H,10H2,1H3
InChIKeyZVXLODDMINVWJE-UHFFFAOYSA-N
XLogP2.71
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methyl-4-(trifluoromethyl)benzamide
CID 134115833
2-benzoyl-5-fluoro-2,3-dihydroinden-1-one
CID 116531409
N-[(1R)-5-fluoro-2,3-dihydro-1H-inden-1-yl]-N-methylbenzamide
CID 144743792
2-[(2S)-6-fluoro-3-oxo-1,2-dihydroinden-2-yl]acetic acid
CID 93492412
2-[(dimethylamino)methyl]-5-fluoro-2,3-dihydroinden-1-one
CID 68805219
(2S)-2-amino-5-fluoro-2,3-dihydroinden-1-one
CID 98010345
(6-fluoro-3-oxo-1,2-dihydroinden-2-yl) acetate
CID 175010012
2-chloro-5-fluoro-2,3-dihydroinden-1-one
CID 116531382
(2R)-2-bromo-5-fluoro-2,3-dihydroinden-1-one
CID 86313607
N-methyl-N-(2-oxocyclohexyl)benzamide
CID 10977310
N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-2-iodobenzamide
CID 134106187
N-[(3E)-3-[(2,2-difluoro-1,3-benzodioxol-5-yl)carbamoylhydrazinylidene]-6-fluoro-1,2-dihydroinden-2-yl]-4-fluoro-N-methylbenzamide
CID 134093638

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide?
The IUPAC name of N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide (CID 134118733) is N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide.
What is the SMILES notation for N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide?
The canonical SMILES for N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide is CN(C(=O)c1ccccc1)C1Cc2cc(F)ccc2C1=O.
What is the InChIKey of N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide?
The InChIKey is ZVXLODDMINVWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c1-19(17(21)11-5-3-2-4-6-11)15-10-12-9-13(18)7-8-14(12)16(15)20/h2-9,15H,10H2,1H3.
What are the key properties of N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide?
N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide has a molecular weight of 283.30 g/mol, XLogP of 2.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-3-oxo-1,2-dihydroinden-2-yl)-N-methylbenzamide is sourced from PubChem (CID 134118733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).