N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide

C19H20N2O3S — CID 35541261

IUPACN-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1cccc(NS(=O)(=O)c2ccc3c(c2)CCC3)c1)C1CC1
InChIInChI=1S/C19H20N2O3S/c22-19(14-7-8-14)20-16-5-2-6-17(12-16)21-25(23,24)18-10-9-13-3-1-4-15(13)11-18/h2,5-6,9-12,14,21H,1,3-4,7-8H2,(H,20,22)
InChIKeyTULJACNDCXSCIY-UHFFFAOYSA-N
MW356.45 g/mol
LogP3.32
Rot. Bonds5

About N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide

N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide (PubChem CID 35541261) has the molecular formula C19H20N2O3S and a molecular weight of 356.45 g/mol. Its IUPAC name is N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide
PubChem CID35541261
Molecular FormulaC19H20N2O3S
Molecular Weight356.45 g/mol
Exact Mass356.12
IUPAC NameN-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1cccc(NS(=O)(=O)c2ccc3c(c2)CCC3)c1)C1CC1
InChIInChI=1S/C19H20N2O3S/c22-19(14-7-8-14)20-16-5-2-6-17(12-16)21-25(23,24)18-10-9-13-3-1-4-15(13)11-18/h2,5-6,9-12,14,21H,1,3-4,7-8H2,(H,20,22)
InChIKeyTULJACNDCXSCIY-UHFFFAOYSA-N
XLogP3.32
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(3,4-difluorophenyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 35540844
N-[3-[(4-methylphenyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 35540803
N-[3-[(3-bromophenyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 35541087
N-[3-[(4-nitrophenyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 35540750
N-[3-[(3,5-dichlorophenyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 35541069
N-[3-[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 43055164
N-[3-(bromomethyl)phenyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 114298978
N-[3-[(2,6-difluorophenyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 35541103
4-[[3-(cyclopropanecarbonylamino)phenyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid
CID 51106119
[4-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]urea
CID 33488490
N-[3-(sulfamoylamino)phenyl]cyclohexanecarboxamide
CID 60729878
N-[4-[(3-sulfamoylphenyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 30287313

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide (CID 35541261) is N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide is O=C(Nc1cccc(NS(=O)(=O)c2ccc3c(c2)CCC3)c1)C1CC1.
What is the InChIKey of N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide?
The InChIKey is TULJACNDCXSCIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3S/c22-19(14-7-8-14)20-16-5-2-6-17(12-16)21-25(23,24)18-10-9-13-3-1-4-15(13)11-18/h2,5-6,9-12,14,21H,1,3-4,7-8H2,(H,20,22).
What are the key properties of N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide?
N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide has a molecular weight of 356.45 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 35541261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).