2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine

C12H25N3O2S — CID 106608854

IUPAC2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine
SMILESCCCNS(=O)(=O)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C12H25N3O2S/c1-2-7-14-18(16,17)15(9-11-5-6-11)10-12-4-3-8-13-12/h11-14H,2-10H2,1H3
InChIKeySGCCFOQQNNHIFW-UHFFFAOYSA-N
MW275.42 g/mol
LogP0.69
Rot. Bonds8

About 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine

2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine (PubChem CID 106608854) has the molecular formula C12H25N3O2S and a molecular weight of 275.42 g/mol. Its IUPAC name is 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine.

Molecular Properties

Compound Name2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine
PubChem CID106608854
Molecular FormulaC12H25N3O2S
Molecular Weight275.42 g/mol
Exact Mass275.17
IUPAC Name2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine
SMILESCCCNS(=O)(=O)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C12H25N3O2S/c1-2-7-14-18(16,17)15(9-11-5-6-11)10-12-4-3-8-13-12/h11-14H,2-10H2,1H3
InChIKeySGCCFOQQNNHIFW-UHFFFAOYSA-N
XLogP0.69
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide
CID 106608788
2-[2-(dipropylsulfamoylamino)ethyl]pyrrolidine
CID 114794083
2-[2-(diethylsulfamoylamino)ethyl]pyrrolidine
CID 114794250
2-[[butyl(2,2,2-trifluoroethylsulfamoyl)amino]methyl]pyrrolidine
CID 106609173
N-propyl-2-pyrrolidin-2-ylethanesulfonamide
CID 115071362
N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106608787
2-[[[cyclopropylmethyl(methyl)sulfamoyl]amino]methyl]pyrrolidine;hydrochloride
CID 119974046
N-(cyclopropylmethyl)-4-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608896
ethyl 2-[cyclopropylmethyl(pyrrolidin-2-ylmethyl)sulfamoyl]acetate
CID 106608776
N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106608711
N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608661
2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine
CID 106630652

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine?
The IUPAC name of 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine (CID 106608854) is 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine.
What is the SMILES notation for 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine?
The canonical SMILES for 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine is CCCNS(=O)(=O)N(CC1CC1)CC1CCCN1.
What is the InChIKey of 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine?
The InChIKey is SGCCFOQQNNHIFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S/c1-2-7-14-18(16,17)15(9-11-5-6-11)10-12-4-3-8-13-12/h11-14H,2-10H2,1H3.
What are the key properties of 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine?
2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine has a molecular weight of 275.42 g/mol, XLogP of 0.69, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine is sourced from PubChem (CID 106608854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).