N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide

C17H16N2O3S — CID 154865387

IUPACN-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide
SMILESO=C1CCc2ccc(S(=O)(=O)Nc3cnc4c(c3)CCC4)cc21
InChIInChI=1S/C17H16N2O3S/c20-17-7-5-11-4-6-14(9-15(11)17)23(21,22)19-13-8-12-2-1-3-16(12)18-10-13/h4,6,8-10,19H,1-3,5,7H2
InChIKeyCPGFSHLBAIMVEZ-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.50
Rot. Bonds3

About N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide

N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide (PubChem CID 154865387) has the molecular formula C17H16N2O3S and a molecular weight of 328.39 g/mol. Its IUPAC name is N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide.

Molecular Properties

Compound NameN-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide
PubChem CID154865387
Molecular FormulaC17H16N2O3S
Molecular Weight328.39 g/mol
Exact Mass328.09
IUPAC NameN-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide
SMILESO=C1CCc2ccc(S(=O)(=O)Nc3cnc4c(c3)CCC4)cc21
InChIInChI=1S/C17H16N2O3S/c20-17-7-5-11-4-6-14(9-15(11)17)23(21,22)19-13-8-12-2-1-3-16(12)18-10-13/h4,6,8-10,19H,1-3,5,7H2
InChIKeyCPGFSHLBAIMVEZ-UHFFFAOYSA-N
XLogP2.50
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-2-methyl-1,3-benzoxazole-6-sulfonamide
CID 167904396
N-pyrimidin-5-yl-2,3-dihydro-1H-indene-5-sulfonamide
CID 167882461
N-(8-oxo-6,7-dihydro-5H-naphthalen-2-yl)methanesulfonamide
CID 14985976
8-oxo-N-[3-(6-piperidin-1-ylpyridazin-3-yl)phenyl]-6,7-dihydro-5H-naphthalene-2-sulfonamide
CID 30595881
8-oxo-N-[3-(3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl]-6,7-dihydro-5H-naphthalene-2-sulfonamide
CID 16873819
1-(4-chlorophenyl)-3-[(3-oxo-1,2-dihydroinden-5-yl)sulfonyl]urea
CID 19783515
N-(2-chloro-4-pyridinyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 103944070
3-chloro-N-(2,3-dihydro-1H-inden-5-yl)-4-methylbenzenesulfonamide
CID 5019779
N-[6-(benzylamino)-3-pyridinyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 113011505
2-pyrrolidin-1-yl-5-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)pyridine-3-carboxylic acid
CID 53004776
N-(2-cyclopropylpyrimidin-5-yl)-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide
CID 166190507
N-(6-oxo-1H-pyridin-3-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 110724962

Frequently Asked Questions

What is the IUPAC name of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide?
The IUPAC name of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide (CID 154865387) is N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide.
What is the SMILES notation for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide?
The canonical SMILES for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide is O=C1CCc2ccc(S(=O)(=O)Nc3cnc4c(c3)CCC4)cc21.
What is the InChIKey of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide?
The InChIKey is CPGFSHLBAIMVEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3S/c20-17-7-5-11-4-6-14(9-15(11)17)23(21,22)19-13-8-12-2-1-3-16(12)18-10-13/h4,6,8-10,19H,1-3,5,7H2.
What are the key properties of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide?
N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide has a molecular weight of 328.39 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-3-oxo-1,2-dihydroindene-5-sulfonamide is sourced from PubChem (CID 154865387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).