(3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide

C7H17N3O2S — CID 104978147

IUPAC(3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide
SMILESCC(C)NS(=O)(=O)N1CC[C@@H](N)C1
InChIInChI=1S/C7H17N3O2S/c1-6(2)9-13(11,12)10-4-3-7(8)5-10/h6-7,9H,3-5,8H2,1-2H3/t7-/m1/s1
InChIKeyREOYQTKWJPIEDQ-SSDOTTSWSA-N
MW207.30 g/mol
LogP-0.74
Rot. Bonds3

About (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide

(3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide (PubChem CID 104978147) has the molecular formula C7H17N3O2S and a molecular weight of 207.30 g/mol. Its IUPAC name is (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name(3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide
PubChem CID104978147
Molecular FormulaC7H17N3O2S
Molecular Weight207.30 g/mol
Exact Mass207.10
IUPAC Name(3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide
SMILESCC(C)NS(=O)(=O)N1CC[C@@H](N)C1
InChIInChI=1S/C7H17N3O2S/c1-6(2)9-13(11,12)10-4-3-7(8)5-10/h6-7,9H,3-5,8H2,1-2H3/t7-/m1/s1
InChIKeyREOYQTKWJPIEDQ-SSDOTTSWSA-N
XLogP-0.74
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylamino)-N-propan-2-ylpiperidine-1-sulfonamide
CID 114803086
(3S)-3-amino-N-methyl-N-propan-2-ylpyrrolidine-1-sulfonamide
CID 94340197
3-(2-hydroxyethyl)-N-propan-2-ylpiperidine-1-sulfonamide
CID 115969767
(3S)-1-methylsulfonylpyrrolidin-3-amine;hydrochloride
CID 66672546
3-methyl-N-propan-2-ylpiperazine-1-sulfonamide
CID 114810913
3-[(2-methylpropylamino)methyl]-N-propan-2-ylpiperidine-1-sulfonamide
CID 114813108
1-(propan-2-ylsulfamoyl)piperidine-3-carboximidamide
CID 114813516
2-methyl-N-propan-2-ylmorpholine-4-sulfonamide
CID 110631373
(3R)-1-(2-methylbutylsulfonyl)pyrrolidin-3-amine
CID 119962777
4-(aminomethyl)-N-pentan-2-ylpiperidine-1-sulfonamide
CID 114140369
ethyl 1-(propan-2-ylsulfamoyl)piperidine-4-carboxylate
CID 60731767
3-amino-N-propylpiperidine-1-sulfonamide
CID 114803216

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide?
The IUPAC name of (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide (CID 104978147) is (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide.
What is the SMILES notation for (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide?
The canonical SMILES for (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide is CC(C)NS(=O)(=O)N1CC[C@@H](N)C1.
What is the InChIKey of (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide?
The InChIKey is REOYQTKWJPIEDQ-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H17N3O2S/c1-6(2)9-13(11,12)10-4-3-7(8)5-10/h6-7,9H,3-5,8H2,1-2H3/t7-/m1/s1.
What are the key properties of (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide?
(3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide has a molecular weight of 207.30 g/mol, XLogP of -0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-N-propan-2-ylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 104978147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).