N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide

C19H23N3O3S — CID 47908934

IUPACN-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
SMILESCS(=O)(=O)N1CCCC(NC(=O)c2c3c(nc4ccccc24)CCC3)C1
InChIInChI=1S/C19H23N3O3S/c1-26(24,25)22-11-5-6-13(12-22)20-19(23)18-14-7-2-3-9-16(14)21-17-10-4-8-15(17)18/h2-3,7,9,13H,4-6,8,10-12H2,1H3,(H,20,23)
InChIKeyOZXFBMOSRDYHNO-UHFFFAOYSA-N
MW373.48 g/mol
LogP1.88
Rot. Bonds3

About N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide

N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide (PubChem CID 47908934) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide.

Molecular Properties

Compound NameN-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
PubChem CID47908934
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC NameN-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
SMILESCS(=O)(=O)N1CCCC(NC(=O)c2c3c(nc4ccccc24)CCC3)C1
InChIInChI=1S/C19H23N3O3S/c1-26(24,25)22-11-5-6-13(12-22)20-19(23)18-14-7-2-3-9-16(14)21-17-10-4-8-15(17)18/h2-3,7,9,13H,4-6,8,10-12H2,1H3,(H,20,23)
InChIKeyOZXFBMOSRDYHNO-UHFFFAOYSA-N
XLogP1.88
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxamide
CID 2451567
N-[1-(3-methylbut-2-enyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 56568880
N-cyclopropyl-2-[(1-methylsulfonylpiperidin-3-yl)amino]quinoline-4-carboxamide
CID 133274243
4-[(1-methylsulfonylpiperidin-3-yl)carbamoyl]benzoic acid
CID 119182615
2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
CID 14385689
N-(1-methylsulfonylpiperidin-3-yl)-1-phenyl-1,2,4-triazole-3-carboxamide
CID 146124574
(2R)-N-cycloheptyl-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 7886798
N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 7642453
4-methyl-N-(1-methylsulfonylpiperidin-3-yl)benzamide
CID 47910179
2,3-dimethyl-N-(1-methylsulfonylpiperidin-3-yl)benzamide
CID 47910133
5-[(1-methylsulfonylpiperidin-3-yl)carbamoyl]thiophene-2-carboxylic acid
CID 119182612
N'-phenyl-1,2,3,4-tetrahydroacridine-9-carbohydrazide
CID 21203873

Frequently Asked Questions

What is the IUPAC name of N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide?
The IUPAC name of N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide (CID 47908934) is N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide.
What is the SMILES notation for N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide?
The canonical SMILES for N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide is CS(=O)(=O)N1CCCC(NC(=O)c2c3c(nc4ccccc24)CCC3)C1.
What is the InChIKey of N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide?
The InChIKey is OZXFBMOSRDYHNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-26(24,25)22-11-5-6-13(12-22)20-19(23)18-14-7-2-3-9-16(14)21-17-10-4-8-15(17)18/h2-3,7,9,13H,4-6,8,10-12H2,1H3,(H,20,23).
What are the key properties of N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide?
N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide has a molecular weight of 373.48 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylsulfonylpiperidin-3-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide is sourced from PubChem (CID 47908934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).