N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide

C12H25N3O2S — CID 43523454

IUPACN-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide
SMILESCC(NS(=O)(=O)N1CCCCC1)C1CCCNC1
InChIInChI=1S/C12H25N3O2S/c1-11(12-6-5-7-13-10-12)14-18(16,17)15-8-3-2-4-9-15/h11-14H,2-10H2,1H3
InChIKeyKLIDWXAKGXQWTJ-UHFFFAOYSA-N
MW275.42 g/mol
LogP0.69
Rot. Bonds4

About N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide

N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide (PubChem CID 43523454) has the molecular formula C12H25N3O2S and a molecular weight of 275.42 g/mol. Its IUPAC name is N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide
PubChem CID43523454
Molecular FormulaC12H25N3O2S
Molecular Weight275.42 g/mol
Exact Mass275.17
IUPAC NameN-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide
SMILESCC(NS(=O)(=O)N1CCCCC1)C1CCCNC1
InChIInChI=1S/C12H25N3O2S/c1-11(12-6-5-7-13-10-12)14-18(16,17)15-8-3-2-4-9-15/h11-14H,2-10H2,1H3
InChIKeyKLIDWXAKGXQWTJ-UHFFFAOYSA-N
XLogP0.69
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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-(1-cyclohexylethyl)piperazine-1-sulfonamide
CID 62407590
N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride
CID 120716711
2-(1-piperidin-3-ylethylsulfamoyl)propanoic acid
CID 62047248
N-(1-piperidin-3-ylethyl)piperidine-1-carboxamide
CID 79155447
N-(1-piperidin-3-ylethyl)butane-1-sulfonamide
CID 43523463
N-pyrrolidin-3-ylazepane-1-sulfonamide;hydrochloride
CID 119966821
N-propan-2-yl-1,4-diazepane-1-sulfonamide;hydrochloride
CID 120999320
1-(1-piperidin-3-ylethyl)-3-propan-2-ylurea
CID 43523388
N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]azepane-1-sulfonamide
CID 35612991
N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide
CID 119052630
N-(1-piperidin-3-ylethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide;hydrochloride
CID 120874795
3,5-dichloro-N-(1-piperidin-3-ylethyl)benzenesulfonamide;hydrochloride
CID 119970234

Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide?
The IUPAC name of N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide (CID 43523454) is N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide?
The canonical SMILES for N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide is CC(NS(=O)(=O)N1CCCCC1)C1CCCNC1.
What is the InChIKey of N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide?
The InChIKey is KLIDWXAKGXQWTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S/c1-11(12-6-5-7-13-10-12)14-18(16,17)15-8-3-2-4-9-15/h11-14H,2-10H2,1H3.
What are the key properties of N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide?
N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide has a molecular weight of 275.42 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide is sourced from PubChem (CID 43523454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).