N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide

C16H30N2O2S — CID 71889779

IUPACN-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide
SMILESCN(C1CCCCC1)S(=O)(=O)N1CCCC1C1CCCC1
InChIInChI=1S/C16H30N2O2S/c1-17(15-10-3-2-4-11-15)21(19,20)18-13-7-12-16(18)14-8-5-6-9-14/h14-16H,2-13H2,1H3
InChIKeyJAIZRRCBSIPTBZ-UHFFFAOYSA-N
MW314.50 g/mol
LogP3.15
Rot. Bonds4

About N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide

N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide (PubChem CID 71889779) has the molecular formula C16H30N2O2S and a molecular weight of 314.50 g/mol. Its IUPAC name is N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide
PubChem CID71889779
Molecular FormulaC16H30N2O2S
Molecular Weight314.50 g/mol
Exact Mass314.20
IUPAC NameN-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide
SMILESCN(C1CCCCC1)S(=O)(=O)N1CCCC1C1CCCC1
InChIInChI=1S/C16H30N2O2S/c1-17(15-10-3-2-4-11-15)21(19,20)18-13-7-12-16(18)14-8-5-6-9-14/h14-16H,2-13H2,1H3
InChIKeyJAIZRRCBSIPTBZ-UHFFFAOYSA-N
XLogP3.15
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.50
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide?
The IUPAC name of N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide (CID 71889779) is N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide.
What is the SMILES notation for N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide?
The canonical SMILES for N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide is CN(C1CCCCC1)S(=O)(=O)N1CCCC1C1CCCC1.
What is the InChIKey of N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide?
The InChIKey is JAIZRRCBSIPTBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2S/c1-17(15-10-3-2-4-11-15)21(19,20)18-13-7-12-16(18)14-8-5-6-9-14/h14-16H,2-13H2,1H3.
What are the key properties of N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide?
N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide has a molecular weight of 314.50 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-cyclopentyl-N-methylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 71889779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).