N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide

C15H20N2O3S — CID 20858702

IUPACN-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESO=C1Cc2cc(S(=O)(=O)NC3CCCCCC3)ccc2N1
InChIInChI=1S/C15H20N2O3S/c18-15-10-11-9-13(7-8-14(11)16-15)21(19,20)17-12-5-3-1-2-4-6-12/h7-9,12,17H,1-6,10H2,(H,16,18)
InChIKeyGRCPSONAOVFPMV-UHFFFAOYSA-N
MW308.40 g/mol
LogP2.18
Rot. Bonds3

About N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide

N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide (PubChem CID 20858702) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide
PubChem CID20858702
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC NameN-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESO=C1Cc2cc(S(=O)(=O)NC3CCCCCC3)ccc2N1
InChIInChI=1S/C15H20N2O3S/c18-15-10-11-9-13(7-8-14(11)16-15)21(19,20)17-12-5-3-1-2-4-6-12/h7-9,12,17H,1-6,10H2,(H,16,18)
InChIKeyGRCPSONAOVFPMV-UHFFFAOYSA-N
XLogP2.18
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide (CID 20858702) is N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide is O=C1Cc2cc(S(=O)(=O)NC3CCCCCC3)ccc2N1.
What is the InChIKey of N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide?
The InChIKey is GRCPSONAOVFPMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c18-15-10-11-9-13(7-8-14(11)16-15)21(19,20)17-12-5-3-1-2-4-6-12/h7-9,12,17H,1-6,10H2,(H,16,18).
What are the key properties of N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide?
N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide has a molecular weight of 308.40 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 20858702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).