2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide

C14H20N4O3S — CID 71929033

IUPAC2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide
SMILESCN(CCn1cccn1)S(=O)(=O)N1CCCC1c1ccco1
InChIInChI=1S/C14H20N4O3S/c1-16(10-11-17-8-4-7-15-17)22(19,20)18-9-2-5-13(18)14-6-3-12-21-14/h3-4,6-8,12-13H,2,5,9-11H2,1H3
InChIKeyMDDKUSFBIKCADS-UHFFFAOYSA-N
MW324.41 g/mol
LogP1.49
Rot. Bonds6

About 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide

2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide (PubChem CID 71929033) has the molecular formula C14H20N4O3S and a molecular weight of 324.41 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide
PubChem CID71929033
Molecular FormulaC14H20N4O3S
Molecular Weight324.41 g/mol
Exact Mass324.13
IUPAC Name2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide
SMILESCN(CCn1cccn1)S(=O)(=O)N1CCCC1c1ccco1
InChIInChI=1S/C14H20N4O3S/c1-16(10-11-17-8-4-7-15-17)22(19,20)18-9-2-5-13(18)14-6-3-12-21-14/h3-4,6-8,12-13H,2,5,9-11H2,1H3
InChIKeyMDDKUSFBIKCADS-UHFFFAOYSA-N
XLogP1.49
TPSA71.58 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.41
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide?
The IUPAC name of 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide (CID 71929033) is 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide is CN(CCn1cccn1)S(=O)(=O)N1CCCC1c1ccco1.
What is the InChIKey of 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide?
The InChIKey is MDDKUSFBIKCADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3S/c1-16(10-11-17-8-4-7-15-17)22(19,20)18-9-2-5-13(18)14-6-3-12-21-14/h3-4,6-8,12-13H,2,5,9-11H2,1H3.
What are the key properties of 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide?
2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide has a molecular weight of 324.41 g/mol, XLogP of 1.49, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 71929033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).