(2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide

C11H23N3O3S — CID 94187276

IUPAC(2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide
SMILESCCCN(CCC)S(=O)(=O)N1CCC[C@H]1C(N)=O
InChIInChI=1S/C11H23N3O3S/c1-3-7-13(8-4-2)18(16,17)14-9-5-6-10(14)11(12)15/h10H,3-9H2,1-2H3,(H2,12,15)/t10-/m0/s1
InChIKeyWCBLCUVYECATRX-JTQLQIEISA-N
MW277.39 g/mol
LogP0.30
Rot. Bonds7

About (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide

(2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide (PubChem CID 94187276) has the molecular formula C11H23N3O3S and a molecular weight of 277.39 g/mol. Its IUPAC name is (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide
PubChem CID94187276
Molecular FormulaC11H23N3O3S
Molecular Weight277.39 g/mol
Exact Mass277.15
IUPAC Name(2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide
SMILESCCCN(CCC)S(=O)(=O)N1CCC[C@H]1C(N)=O
InChIInChI=1S/C11H23N3O3S/c1-3-7-13(8-4-2)18(16,17)14-9-5-6-10(14)11(12)15/h10H,3-9H2,1-2H3,(H2,12,15)/t10-/m0/s1
InChIKeyWCBLCUVYECATRX-JTQLQIEISA-N
XLogP0.30
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide (CID 94187276) is (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide is CCCN(CCC)S(=O)(=O)N1CCC[C@H]1C(N)=O.
What is the InChIKey of (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide?
The InChIKey is WCBLCUVYECATRX-JTQLQIEISA-N. The full InChI is InChI=1S/C11H23N3O3S/c1-3-7-13(8-4-2)18(16,17)14-9-5-6-10(14)11(12)15/h10H,3-9H2,1-2H3,(H2,12,15)/t10-/m0/s1.
What are the key properties of (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide?
(2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide has a molecular weight of 277.39 g/mol, XLogP of 0.30, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(dipropylsulfamoyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 94187276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).