2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine

C12H25N3O2S — CID 106630652

IUPAC2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine
SMILESCCCN(CC1CCCCN1)S(=O)(=O)NC1CC1
InChIInChI=1S/C12H25N3O2S/c1-2-9-15(10-12-5-3-4-8-13-12)18(16,17)14-11-6-7-11/h11-14H,2-10H2,1H3
InChIKeyHVMVBYZIVSHPLP-UHFFFAOYSA-N
MW275.42 g/mol
LogP0.84
Rot. Bonds7

About 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine

2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine (PubChem CID 106630652) has the molecular formula C12H25N3O2S and a molecular weight of 275.42 g/mol. Its IUPAC name is 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine.

Molecular Properties

Compound Name2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine
PubChem CID106630652
Molecular FormulaC12H25N3O2S
Molecular Weight275.42 g/mol
Exact Mass275.17
IUPAC Name2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine
SMILESCCCN(CC1CCCCN1)S(=O)(=O)NC1CC1
InChIInChI=1S/C12H25N3O2S/c1-2-9-15(10-12-5-3-4-8-13-12)18(16,17)14-11-6-7-11/h11-14H,2-10H2,1H3
InChIKeyHVMVBYZIVSHPLP-UHFFFAOYSA-N
XLogP0.84
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-2-ylmethyl)-N-propylcyclohexanesulfonamide
CID 106630664
1-methylsulfonyl-N-propyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106608529
2-[2-(dipropylsulfamoylamino)ethyl]pyrrolidine
CID 114794083
5-chloro-N-(piperidin-2-ylmethyl)-N-propylthiophene-2-sulfonamide
CID 106630606
[[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane
CID 114803733
N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
CID 106630421
N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
CID 106599557
N-(piperidin-2-ylmethyl)-N-propyl-1H-imidazole-5-sulfonamide
CID 106630692
N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide
CID 106608788
N-(4-methylcyclohexyl)-1-piperidin-2-ylmethanesulfonamide
CID 54973720
2-[[butyl(2,2,2-trifluoroethylsulfamoyl)amino]methyl]pyrrolidine
CID 106609173
3-bromo-N-(piperidin-2-ylmethyl)-N-propylbenzenesulfonamide
CID 106630601

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine?
The IUPAC name of 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine (CID 106630652) is 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine.
What is the SMILES notation for 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine?
The canonical SMILES for 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine is CCCN(CC1CCCCN1)S(=O)(=O)NC1CC1.
What is the InChIKey of 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine?
The InChIKey is HVMVBYZIVSHPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S/c1-2-9-15(10-12-5-3-4-8-13-12)18(16,17)14-11-6-7-11/h11-14H,2-10H2,1H3.
What are the key properties of 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine?
2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine has a molecular weight of 275.42 g/mol, XLogP of 0.84, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine is sourced from PubChem (CID 106630652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).