1-propylpiperidine-3-sulfonamide

C8H18N2O2S — CID 130991940

IUPAC1-propylpiperidine-3-sulfonamide
SMILESCCCN1CCCC(S(N)(=O)=O)C1
InChIInChI=1S/C8H18N2O2S/c1-2-5-10-6-3-4-8(7-10)13(9,11)12/h8H,2-7H2,1H3,(H2,9,11,12)
InChIKeyLHCZEYFQGDZLLY-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.15
Rot. Bonds3

About 1-propylpiperidine-3-sulfonamide

1-propylpiperidine-3-sulfonamide (PubChem CID 130991940) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is 1-propylpiperidine-3-sulfonamide.

Molecular Properties

Compound Name1-propylpiperidine-3-sulfonamide
PubChem CID130991940
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC Name1-propylpiperidine-3-sulfonamide
SMILESCCCN1CCCC(S(N)(=O)=O)C1
InChIInChI=1S/C8H18N2O2S/c1-2-5-10-6-3-4-8(7-10)13(9,11)12/h8H,2-7H2,1H3,(H2,9,11,12)
InChIKeyLHCZEYFQGDZLLY-UHFFFAOYSA-N
XLogP0.15
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

piperidine-1,3-disulfonamide
CID 115897696
ethyl (3S)-1-propylpiperidine-3-carboxylate
CID 51669174
1-[(5-methylpyrazin-2-yl)methyl]piperidine-3-sulfonamide
CID 136530385
3-methyl-1-propylpiperidine;propane
CID 145147959
ethane;3-methyl-1-propylpiperidine
CID 156729460
3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide
CID 115608712
N,N-diethyl-3-sulfamoylpiperidine-1-carboxamide
CID 79162189
[(3S)-1-propylpiperidin-3-yl]carbamic acid
CID 118936390
3-(3-methylsulfonylpiperidin-1-yl)propanenitrile
CID 130617291
2-[3-(aminomethyl)piperidin-1-yl]ethanesulfonamide
CID 114385443
(3S)-1-[2-(dimethylamino)acetyl]piperidine-3-sulfonamide
CID 129414224
(2R)-1-(3-methylsulfonylpiperidin-1-yl)propan-2-amine
CID 130715172

Frequently Asked Questions

What is the IUPAC name of 1-propylpiperidine-3-sulfonamide?
The IUPAC name of 1-propylpiperidine-3-sulfonamide (CID 130991940) is 1-propylpiperidine-3-sulfonamide.
What is the SMILES notation for 1-propylpiperidine-3-sulfonamide?
The canonical SMILES for 1-propylpiperidine-3-sulfonamide is CCCN1CCCC(S(N)(=O)=O)C1.
What is the InChIKey of 1-propylpiperidine-3-sulfonamide?
The InChIKey is LHCZEYFQGDZLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-2-5-10-6-3-4-8(7-10)13(9,11)12/h8H,2-7H2,1H3,(H2,9,11,12).
What are the key properties of 1-propylpiperidine-3-sulfonamide?
1-propylpiperidine-3-sulfonamide has a molecular weight of 206.31 g/mol, XLogP of 0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propylpiperidine-3-sulfonamide is sourced from PubChem (CID 130991940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).