N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride

C10H22ClN3O2S — CID 120716711

IUPACN-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(N[C@H]1CCCNC1)N1CCCCC1
InChIInChI=1S/C10H21N3O2S.ClH/c14-16(15,13-7-2-1-3-8-13)12-10-5-4-6-11-9-10;/h10-12H,1-9H2;1H/t10-;/m0./s1
InChIKeyDTYGKAHFOGAMDJ-PPHPATTJSA-N
MW283.82 g/mol
LogP0.48
Rot. Bonds3

About N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride

N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride (PubChem CID 120716711) has the molecular formula C10H22ClN3O2S and a molecular weight of 283.82 g/mol. Its IUPAC name is N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride
PubChem CID120716711
Molecular FormulaC10H22ClN3O2S
Molecular Weight283.82 g/mol
Exact Mass283.11
IUPAC NameN-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(N[C@H]1CCCNC1)N1CCCCC1
InChIInChI=1S/C10H21N3O2S.ClH/c14-16(15,13-7-2-1-3-8-13)12-10-5-4-6-11-9-10;/h10-12H,1-9H2;1H/t10-;/m0./s1
InChIKeyDTYGKAHFOGAMDJ-PPHPATTJSA-N
XLogP0.48
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.82
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-pyrrolidin-3-ylazepane-1-sulfonamide;hydrochloride
CID 119966821
N-cycloheptylpiperidine-1-sulfonamide
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ethyl 1-[[(3S)-piperidin-3-yl]sulfamoyl]piperidine-4-carboxylate
CID 104982617
N-cyclopropylpyrrolidine-1-sulfonamide
CID 60723889
N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide
CID 43523454
N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide
CID 79685144
N-(6-oxopiperidin-3-yl)azepane-1-sulfonamide
CID 55244528
N-piperidin-3-yl-2-pyrrolidin-1-ylsulfonylbenzenesulfonamide
CID 120707123
N-[(3S)-piperidin-3-yl]ethanesulfonamide;hydrochloride
CID 53256488
N-[4-(methylamino)cyclohexyl]piperidine-1-sulfonamide
CID 43653532
(3R)-3-(dimethylsulfamoylamino)piperidine;hydrochloride
CID 120723788
N-(2-methylpiperidin-4-yl)azepane-1-sulfonamide
CID 106995874

Frequently Asked Questions

What is the IUPAC name of N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride?
The IUPAC name of N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride (CID 120716711) is N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride is Cl.O=S(=O)(N[C@H]1CCCNC1)N1CCCCC1.
What is the InChIKey of N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride?
The InChIKey is DTYGKAHFOGAMDJ-PPHPATTJSA-N. The full InChI is InChI=1S/C10H21N3O2S.ClH/c14-16(15,13-7-2-1-3-8-13)12-10-5-4-6-11-9-10;/h10-12H,1-9H2;1H/t10-;/m0./s1.
What are the key properties of N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride?
N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride has a molecular weight of 283.82 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-piperidin-3-yl]piperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 120716711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).