N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride

C7H18ClN3O2S — CID 119959959

IUPACN-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride
SMILESCl.NCCNS(=O)(=O)N1CCCCC1
InChIInChI=1S/C7H17N3O2S.ClH/c8-4-5-9-13(11,12)10-6-2-1-3-7-10;/h9H,1-8H2;1H
InChIKeyFPRXOBMQBJAORP-UHFFFAOYSA-N
MW243.76 g/mol
LogP-0.31
Rot. Bonds4

About N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride

N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride (PubChem CID 119959959) has the molecular formula C7H18ClN3O2S and a molecular weight of 243.76 g/mol. Its IUPAC name is N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride
PubChem CID119959959
Molecular FormulaC7H18ClN3O2S
Molecular Weight243.76 g/mol
Exact Mass243.08
IUPAC NameN-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride
SMILESCl.NCCNS(=O)(=O)N1CCCCC1
InChIInChI=1S/C7H17N3O2S.ClH/c8-4-5-9-13(11,12)10-6-2-1-3-7-10;/h9H,1-8H2;1H
InChIKeyFPRXOBMQBJAORP-UHFFFAOYSA-N
XLogP-0.31
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.76
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)azepane-1-sulfonamide
CID 28785017
N-(6-aminohexyl)piperidine-1-sulfonamide
CID 114008123
N-(3-chloropropyl)piperidine-1-sulfonamide
CID 43133782
N-[2-(ethylamino)ethyl]azepane-1-sulfonamide
CID 62665481
2-(piperidin-1-ylsulfonylamino)ethanesulfonyl chloride
CID 81357870
N-[(3R)-3-aminobutyl]azepane-1-sulfonamide
CID 95037628
N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide
CID 62657611
N-[2-(propylamino)ethyl]azepane-1-sulfonamide
CID 62665322
N-ethylazepane-1-sulfonamide
CID 43213421
3-(azepan-1-ylsulfonylamino)-N'-hydroxypropanimidamide
CID 55102000
N-[3-(ethylsulfonylamino)propyl]azepane-1-sulfonamide
CID 49459638
N-(methylaminomethyl)piperidine-1-sulfonamide
CID 117126231

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride (CID 119959959) is N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride is Cl.NCCNS(=O)(=O)N1CCCCC1.
What is the InChIKey of N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride?
The InChIKey is FPRXOBMQBJAORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O2S.ClH/c8-4-5-9-13(11,12)10-6-2-1-3-7-10;/h9H,1-8H2;1H.
What are the key properties of N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride?
N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride has a molecular weight of 243.76 g/mol, XLogP of -0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 119959959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).