1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide

C10H19N3O2S — CID 55207029

IUPAC1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide
SMILESCC(CNS(=O)(=O)CC#N)N1CCCCC1
InChIInChI=1S/C10H19N3O2S/c1-10(13-6-3-2-4-7-13)9-12-16(14,15)8-5-11/h10,12H,2-4,6-9H2,1H3
InChIKeyUBJHTQXUQOVGFW-UHFFFAOYSA-N
MW245.35 g/mol
LogP0.30
Rot. Bonds5

About 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide

1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide (PubChem CID 55207029) has the molecular formula C10H19N3O2S and a molecular weight of 245.35 g/mol. Its IUPAC name is 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide.

Molecular Properties

Compound Name1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide
PubChem CID55207029
Molecular FormulaC10H19N3O2S
Molecular Weight245.35 g/mol
Exact Mass245.12
IUPAC Name1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide
SMILESCC(CNS(=O)(=O)CC#N)N1CCCCC1
InChIInChI=1S/C10H19N3O2S/c1-10(13-6-3-2-4-7-13)9-12-16(14,15)8-5-11/h10,12H,2-4,6-9H2,1H3
InChIKeyUBJHTQXUQOVGFW-UHFFFAOYSA-N
XLogP0.30
TPSA73.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-chloro-N-(2-piperidin-1-ylpropyl)methanesulfonamide
CID 63663943
1-[1-(sulfamoylamino)propan-2-yl]piperidine
CID 112686143
3-cyano-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
CID 61060484
1-(2-aminophenyl)-N-(2-piperidin-1-ylpropyl)methanesulfonamide
CID 62021095
2-piperidin-1-ylpropylcyanamide
CID 62483292
2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
CID 62152910
3-(azocan-1-yl)butanenitrile
CID 60913131
N-(1-ethylsulfonylpropan-2-yl)-2-piperidin-1-ylpropan-1-amine
CID 113350724
1-(ethylamino)-N-(2-pyrrolidin-1-ylpropyl)propane-2-sulfonamide
CID 106073122
3-pyrrolidin-1-ylbutanenitrile
CID 46318245
2-(2-piperidin-1-ylpropylamino)ethanesulfonamide
CID 114384890
3-amino-N-(2-piperidin-1-ylpropyl)pyridine-2-sulfonamide
CID 103305481

Frequently Asked Questions

What is the IUPAC name of 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide?
The IUPAC name of 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide (CID 55207029) is 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide.
What is the SMILES notation for 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide?
The canonical SMILES for 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide is CC(CNS(=O)(=O)CC#N)N1CCCCC1.
What is the InChIKey of 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide?
The InChIKey is UBJHTQXUQOVGFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2S/c1-10(13-6-3-2-4-7-13)9-12-16(14,15)8-5-11/h10,12H,2-4,6-9H2,1H3.
What are the key properties of 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide?
1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide has a molecular weight of 245.35 g/mol, XLogP of 0.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyano-N-(2-piperidin-1-ylpropyl)methanesulfonamide is sourced from PubChem (CID 55207029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).