N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide

C13H24N2O4S — CID 167789886

IUPACN-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide
SMILESCOC1COCC1S(=O)(=O)NC1CN(C2CC2)CC1C
InChIInChI=1S/C13H24N2O4S/c1-9-5-15(10-3-4-10)6-11(9)14-20(16,17)13-8-19-7-12(13)18-2/h9-14H,3-8H2,1-2H3
InChIKeyUHSLCQZHFVVWHH-UHFFFAOYSA-N
MW304.41 g/mol
LogP-0.20
Rot. Bonds5

About N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide

N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide (PubChem CID 167789886) has the molecular formula C13H24N2O4S and a molecular weight of 304.41 g/mol. Its IUPAC name is N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide
PubChem CID167789886
Molecular FormulaC13H24N2O4S
Molecular Weight304.41 g/mol
Exact Mass304.15
IUPAC NameN-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide
SMILESCOC1COCC1S(=O)(=O)NC1CN(C2CC2)CC1C
InChIInChI=1S/C13H24N2O4S/c1-9-5-15(10-3-4-10)6-11(9)14-20(16,17)13-8-19-7-12(13)18-2/h9-14H,3-8H2,1-2H3
InChIKeyUHSLCQZHFVVWHH-UHFFFAOYSA-N
XLogP-0.20
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.41
LogP ≤ 5-0.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide?
The IUPAC name of N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide (CID 167789886) is N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide.
What is the SMILES notation for N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide?
The canonical SMILES for N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide is COC1COCC1S(=O)(=O)NC1CN(C2CC2)CC1C.
What is the InChIKey of N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide?
The InChIKey is UHSLCQZHFVVWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O4S/c1-9-5-15(10-3-4-10)6-11(9)14-20(16,17)13-8-19-7-12(13)18-2/h9-14H,3-8H2,1-2H3.
What are the key properties of N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide?
N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide has a molecular weight of 304.41 g/mol, XLogP of -0.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-4-methoxyoxolane-3-sulfonamide is sourced from PubChem (CID 167789886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).