N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide

C15H22N2O2S — CID 104773743

IUPACN-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide
SMILESCN(C1CCCC1)S(=O)(=O)c1cccc2c1CCCN2
InChIInChI=1S/C15H22N2O2S/c1-17(12-6-2-3-7-12)20(18,19)15-10-4-9-14-13(15)8-5-11-16-14/h4,9-10,12,16H,2-3,5-8,11H2,1H3
InChIKeyOYMOIFWCXOWCSB-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.61
Rot. Bonds3

About N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide

N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide (PubChem CID 104773743) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide
PubChem CID104773743
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC NameN-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide
SMILESCN(C1CCCC1)S(=O)(=O)c1cccc2c1CCCN2
InChIInChI=1S/C15H22N2O2S/c1-17(12-6-2-3-7-12)20(18,19)15-10-4-9-14-13(15)8-5-11-16-14/h4,9-10,12,16H,2-3,5-8,11H2,1H3
InChIKeyOYMOIFWCXOWCSB-UHFFFAOYSA-N
XLogP2.61
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide?
The IUPAC name of N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide (CID 104773743) is N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide.
What is the SMILES notation for N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide?
The canonical SMILES for N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide is CN(C1CCCC1)S(=O)(=O)c1cccc2c1CCCN2.
What is the InChIKey of N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide?
The InChIKey is OYMOIFWCXOWCSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c1-17(12-6-2-3-7-12)20(18,19)15-10-4-9-14-13(15)8-5-11-16-14/h4,9-10,12,16H,2-3,5-8,11H2,1H3.
What are the key properties of N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide?
N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide has a molecular weight of 294.42 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinoline-5-sulfonamide is sourced from PubChem (CID 104773743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).