N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine

C10H23N3O4S2 — CID 110626645

IUPACN-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine
SMILESCC(C)NS(=O)(=O)NCCS(=O)(=O)N1CCCCC1
InChIInChI=1S/C10H23N3O4S2/c1-10(2)12-19(16,17)11-6-9-18(14,15)13-7-4-3-5-8-13/h10-12H,3-9H2,1-2H3
InChIKeyGEFLEHZIDXDWEM-UHFFFAOYSA-N
MW313.45 g/mol
LogP-0.37
Rot. Bonds7

About N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine

N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine (PubChem CID 110626645) has the molecular formula C10H23N3O4S2 and a molecular weight of 313.45 g/mol. Its IUPAC name is N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine.

Molecular Properties

Compound NameN-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine
PubChem CID110626645
Molecular FormulaC10H23N3O4S2
Molecular Weight313.45 g/mol
Exact Mass313.11
IUPAC NameN-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine
SMILESCC(C)NS(=O)(=O)NCCS(=O)(=O)N1CCCCC1
InChIInChI=1S/C10H23N3O4S2/c1-10(2)12-19(16,17)11-6-9-18(14,15)13-7-4-3-5-8-13/h10-12H,3-9H2,1-2H3
InChIKeyGEFLEHZIDXDWEM-UHFFFAOYSA-N
XLogP-0.37
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.45
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-pyrrolidin-1-ylsulfonylethyl)methanesulfonamide
CID 110345398
N-(2-methylsulfonylethylsulfamoyl)propan-2-amine
CID 110612472
1-(3-methylbutylsulfonyl)piperidine
CID 58689013
1-(2-methylsulfonylethylsulfonyl)azepane
CID 64592112
N-[2-(azepan-1-ylsulfonyl)ethyl]propanamide
CID 110345992
2,5-dimethyl-N-(2-piperidin-1-ylsulfonylethyl)benzenesulfonamide
CID 110287592
2-[[8,15-bis(2-trimethylsilylethylsulfonyl)-1,8,15-triazacyclohenicos-1-yl]sulfonyl]ethyl-trimethylsilane
CID 101272185
1-(2-propan-2-yloxyethylsulfonyl)azepane
CID 79229911
1-(2-pyrrolidin-1-ylethylsulfonyl)piperidine
CID 90877511
1-(6-piperidin-1-ylsulfonylhexylsulfonyl)piperidine
CID 4599987
2-(azepan-1-ylsulfonyl)ethanamine
CID 22692377
2,2-dimethyl-N-(2-pyrrolidin-1-ylsulfonylethyl)propanamide
CID 110345330

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine?
The IUPAC name of N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine (CID 110626645) is N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine.
What is the SMILES notation for N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine?
The canonical SMILES for N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine is CC(C)NS(=O)(=O)NCCS(=O)(=O)N1CCCCC1.
What is the InChIKey of N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine?
The InChIKey is GEFLEHZIDXDWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O4S2/c1-10(2)12-19(16,17)11-6-9-18(14,15)13-7-4-3-5-8-13/h10-12H,3-9H2,1-2H3.
What are the key properties of N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine?
N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine has a molecular weight of 313.45 g/mol, XLogP of -0.37, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylsulfonylethylsulfamoyl)propan-2-amine is sourced from PubChem (CID 110626645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).