N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide

C21H24N2O3S — CID 34108495

IUPACN-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide
SMILESO=C1CCCN1Cc1ccccc1CNS(=O)(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C21H24N2O3S/c24-21-9-4-12-23(21)15-19-6-2-1-5-18(19)14-22-27(25,26)20-11-10-16-7-3-8-17(16)13-20/h1-2,5-6,10-11,13,22H,3-4,7-9,12,14-15H2
InChIKeyRFKVBQQSSFIYKE-UHFFFAOYSA-N
MW384.50 g/mol
LogP2.78
Rot. Bonds6

About N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide

N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide (PubChem CID 34108495) has the molecular formula C21H24N2O3S and a molecular weight of 384.50 g/mol. Its IUPAC name is N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide.

Molecular Properties

Compound NameN-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide
PubChem CID34108495
Molecular FormulaC21H24N2O3S
Molecular Weight384.50 g/mol
Exact Mass384.15
IUPAC NameN-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide
SMILESO=C1CCCN1Cc1ccccc1CNS(=O)(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C21H24N2O3S/c24-21-9-4-12-23(21)15-19-6-2-1-5-18(19)14-22-27(25,26)20-11-10-16-7-3-8-17(16)13-20/h1-2,5-6,10-11,13,22H,3-4,7-9,12,14-15H2
InChIKeyRFKVBQQSSFIYKE-UHFFFAOYSA-N
XLogP2.78
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.50
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 26540045
N-[[2-(diethylaminomethyl)phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 26543166
N-[2-(2-oxoazepan-1-yl)ethyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 39667463
N-[[2-[(dimethylamino)methyl]phenyl]methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 26542362
1-[[2-[(benzylsulfamoylamino)methyl]phenyl]methyl]pyrrolidin-2-one
CID 56903516
3,4-difluoro-N-[[2-[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]phenyl]methyl]benzenesulfonamide
CID 24656984
5-bromo-2-methoxy-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]benzenesulfonamide
CID 34108511
N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 26531885
1-[[2-[[[methyl(propyl)sulfamoyl]amino]methyl]phenyl]methyl]-2-oxopyrrolidine
CID 99578760
2-oxo-N-[[2-[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]phenyl]methyl]chromene-6-sulfonamide
CID 24677975
N-ethyl-2,3-dihydro-1H-indene-5-sulfonamide
CID 43212855
2-[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]acetohydrazide
CID 113314919

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide?
The IUPAC name of N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide (CID 34108495) is N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide.
What is the SMILES notation for N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide?
The canonical SMILES for N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide is O=C1CCCN1Cc1ccccc1CNS(=O)(=O)c1ccc2c(c1)CCC2.
What is the InChIKey of N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide?
The InChIKey is RFKVBQQSSFIYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3S/c24-21-9-4-12-23(21)15-19-6-2-1-5-18(19)14-22-27(25,26)20-11-10-16-7-3-8-17(16)13-20/h1-2,5-6,10-11,13,22H,3-4,7-9,12,14-15H2.
What are the key properties of N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide?
N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide has a molecular weight of 384.50 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-5-sulfonamide is sourced from PubChem (CID 34108495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).