N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide

C8H19N3O2S — CID 61124545

IUPACN-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide
SMILESCC(C)(CN)NS(=O)(=O)N1CCCC1
InChIInChI=1S/C8H19N3O2S/c1-8(2,7-9)10-14(12,13)11-5-3-4-6-11/h10H,3-7,9H2,1-2H3
InChIKeySCIVRKZLOAZOJD-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.35
Rot. Bonds4

About N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide

N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide (PubChem CID 61124545) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide
PubChem CID61124545
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC NameN-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide
SMILESCC(C)(CN)NS(=O)(=O)N1CCCC1
InChIInChI=1S/C8H19N3O2S/c1-8(2,7-9)10-14(12,13)11-5-3-4-6-11/h10H,3-7,9H2,1-2H3
InChIKeySCIVRKZLOAZOJD-UHFFFAOYSA-N
XLogP-0.35
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3S)-3-fluorobutyl]pyrrolidine-1-sulfonamide
CID 164631280
N-(3-fluorobutyl)pyrrolidine-1-sulfonamide
CID 132288047
2-Butyl-1,2,5-thiadiazolidine 1,1-dioxide
CID 11412706
2-(tert-Butyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 12412514
N-propylpyrrolidine-1-sulfonamide
CID 43243225
N-Isopropylpyrrolidine-1-sulfonamide
CID 53256760
1-[2-Methyl-2-(sulfinatoamino)propyl]pyrrolidine
CID 57419768
(4R)-2-(2-methylpropyl)-4-propan-2-yl-1,2,5-thiadiazolidine 1,1-dioxide
CID 57765394
(4S)-2-(2-methylpropyl)-4-propan-2-yl-1,2,5-thiadiazolidine 1,1-dioxide
CID 57765449
2-(3,3-Dimethylbutyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 57974773
2-(2,2-Dimethylpropyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 57974838
N-(3,3-dimethylbutyl)pyrrolidine-1-sulfonamide
CID 58530494

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide (CID 61124545) is N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide is CC(C)(CN)NS(=O)(=O)N1CCCC1.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide?
The InChIKey is SCIVRKZLOAZOJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c1-8(2,7-9)10-14(12,13)11-5-3-4-6-11/h10H,3-7,9H2,1-2H3.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide?
N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide has a molecular weight of 221.33 g/mol, XLogP of -0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 61124545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).