1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole

C16H15N3O3S — CID 46329418

IUPAC1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole
SMILESCc1cc(-c2ccc(S(=O)(=O)N3CCc4ccccc43)o2)n[nH]1
InChIInChI=1S/C16H15N3O3S/c1-11-10-13(18-17-11)15-6-7-16(22-15)23(20,21)19-9-8-12-4-2-3-5-14(12)19/h2-7,10H,8-9H2,1H3,(H,17,18)
InChIKeyQORVARVYSHFJPX-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.73
Rot. Bonds3

About 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole

1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole (PubChem CID 46329418) has the molecular formula C16H15N3O3S and a molecular weight of 329.38 g/mol. Its IUPAC name is 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole
PubChem CID46329418
Molecular FormulaC16H15N3O3S
Molecular Weight329.38 g/mol
Exact Mass329.08
IUPAC Name1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole
SMILESCc1cc(-c2ccc(S(=O)(=O)N3CCc4ccccc43)o2)n[nH]1
InChIInChI=1S/C16H15N3O3S/c1-11-10-13(18-17-11)15-6-7-16(22-15)23(20,21)19-9-8-12-4-2-3-5-14(12)19/h2-7,10H,8-9H2,1H3,(H,17,18)
InChIKeyQORVARVYSHFJPX-UHFFFAOYSA-N
XLogP2.73
TPSA79.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole?
The IUPAC name of 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole (CID 46329418) is 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole.
What is the SMILES notation for 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole?
The canonical SMILES for 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole is Cc1cc(-c2ccc(S(=O)(=O)N3CCc4ccccc43)o2)n[nH]1.
What is the InChIKey of 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole?
The InChIKey is QORVARVYSHFJPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S/c1-11-10-13(18-17-11)15-6-7-16(22-15)23(20,21)19-9-8-12-4-2-3-5-14(12)19/h2-7,10H,8-9H2,1H3,(H,17,18).
What are the key properties of 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole?
1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole has a molecular weight of 329.38 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(5-methyl-1H-pyrazol-3-yl)furan-2-yl]sulfonyl-2,3-dihydroindole is sourced from PubChem (CID 46329418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).