(3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone

C15H11F2NO — CID 4815727

IUPAC(3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1cc(F)cc(F)c1)N1CCc2ccccc21
InChIInChI=1S/C15H11F2NO/c16-12-7-11(8-13(17)9-12)15(19)18-6-5-10-3-1-2-4-14(10)18/h1-4,7-9H,5-6H2
InChIKeyQBKLWZIOKOKSKI-UHFFFAOYSA-N
MW259.25 g/mol
LogP3.17
Rot. Bonds1

About (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone

(3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone (PubChem CID 4815727) has the molecular formula C15H11F2NO and a molecular weight of 259.25 g/mol. Its IUPAC name is (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone
PubChem CID4815727
Molecular FormulaC15H11F2NO
Molecular Weight259.25 g/mol
Exact Mass259.08
IUPAC Name(3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1cc(F)cc(F)c1)N1CCc2ccccc21
InChIInChI=1S/C15H11F2NO/c16-12-7-11(8-13(17)9-12)15(19)18-6-5-10-3-1-2-4-14(10)18/h1-4,7-9H,5-6H2
InChIKeyQBKLWZIOKOKSKI-UHFFFAOYSA-N
XLogP3.17
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.25
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dihydroindol-1-yl-(3-fluoro-4-methylphenyl)methanone
CID 17476941
3-(2,3-dihydroindole-1-carbonyl)benzoic acid
CID 43452867
2,3-dihydroindol-1-yl-(3,5-dimethoxyphenyl)methanone
CID 687165
2,3-dihydroindol-1-yl-(3,4-dimethylphenyl)methanone
CID 669367
(5-bromo-2,3-dihydroindol-1-yl)-(3-bromo-5-fluorophenyl)methanone
CID 47444598
4-(2,3-dihydroindole-1-carbonyl)-N-(4-fluorophenyl)benzamide
CID 109049539
(3,5-difluorophenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 3479388
4-(2,3-dihydroindole-1-carbonyl)-6-methyl-1H-pyridin-2-one
CID 110698689
2,3-dihydroindol-1-yl-(1-methylpyrrol-3-yl)methanone
CID 110762714
1-(2,3-dihydroindol-1-yl)-2-(4-fluorophenyl)ethane-1,2-dione
CID 82123544
3-(2,3-dihydroindole-1-carbonyl)benzaldehyde
CID 90104032
N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049570

Frequently Asked Questions

What is the IUPAC name of (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone (CID 4815727) is (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone is O=C(c1cc(F)cc(F)c1)N1CCc2ccccc21.
What is the InChIKey of (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is QBKLWZIOKOKSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F2NO/c16-12-7-11(8-13(17)9-12)15(19)18-6-5-10-3-1-2-4-14(10)18/h1-4,7-9H,5-6H2.
What are the key properties of (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone?
(3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 259.25 g/mol, XLogP of 3.17, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 4815727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).