3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide

C18H19FN2O3S — CID 110623465

IUPAC3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide
SMILESCS(=O)(=O)N1CCc2cc(NC(=O)CCc3ccccc3F)ccc21
InChIInChI=1S/C18H19FN2O3S/c1-25(23,24)21-11-10-14-12-15(7-8-17(14)21)20-18(22)9-6-13-4-2-3-5-16(13)19/h2-5,7-8,12H,6,9-11H2,1H3,(H,20,22)
InChIKeyGNNPWIVTCHTNFR-UHFFFAOYSA-N
MW362.43 g/mol
LogP2.72
Rot. Bonds5

About 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide

3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide (PubChem CID 110623465) has the molecular formula C18H19FN2O3S and a molecular weight of 362.43 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide
PubChem CID110623465
Molecular FormulaC18H19FN2O3S
Molecular Weight362.43 g/mol
Exact Mass362.11
IUPAC Name3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide
SMILESCS(=O)(=O)N1CCc2cc(NC(=O)CCc3ccccc3F)ccc21
InChIInChI=1S/C18H19FN2O3S/c1-25(23,24)21-11-10-14-12-15(7-8-17(14)21)20-18(22)9-6-13-4-2-3-5-16(13)19/h2-5,7-8,12H,6,9-11H2,1H3,(H,20,22)
InChIKeyGNNPWIVTCHTNFR-UHFFFAOYSA-N
XLogP2.72
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluoro-4-methylphenyl)-3-(1-methylsulfonyl-2,3-dihydroindol-5-yl)urea
CID 46389850
4-(2-methylphenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-6-yl)butanamide
CID 110623662
3-(4-methylphenyl)-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)propanamide
CID 110303774
3,4-difluoro-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)benzamide
CID 112506190
2,6-difluoro-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)benzamide
CID 7657910
N-cyclopropyl-N-[(2-fluorophenyl)methyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
CID 34577851
2-chloro-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)benzamide
CID 112506182
1-(3-methylsulfanylphenyl)-3-(1-methylsulfonyl-2,3-dihydroindol-5-yl)urea
CID 46389806
1-(3,4-dimethylphenyl)-3-(1-methylsulfonyl-2,3-dihydroindol-5-yl)urea
CID 46389828
3-(2-fluorophenyl)-N-[1-(2-methoxyacetyl)-3,4-dihydro-2H-quinolin-7-yl]propanamide
CID 71806499
1-cyclopropyl-3-(1-methylsulfonyl-2,3-dihydroindol-5-yl)urea
CID 110303929
N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-4-pyridin-3-ylbutanamide
CID 110623293

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide?
The IUPAC name of 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide (CID 110623465) is 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide is CS(=O)(=O)N1CCc2cc(NC(=O)CCc3ccccc3F)ccc21.
What is the InChIKey of 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide?
The InChIKey is GNNPWIVTCHTNFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3S/c1-25(23,24)21-11-10-14-12-15(7-8-17(14)21)20-18(22)9-6-13-4-2-3-5-16(13)19/h2-5,7-8,12H,6,9-11H2,1H3,(H,20,22).
What are the key properties of 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide?
3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide has a molecular weight of 362.43 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)propanamide is sourced from PubChem (CID 110623465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).