3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide

C10H22N2O2S — CID 115608712

IUPAC3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide
SMILESCCC1CCCN(CCCS(N)(=O)=O)C1
InChIInChI=1S/C10H22N2O2S/c1-2-10-5-3-6-12(9-10)7-4-8-15(11,13)14/h10H,2-9H2,1H3,(H2,11,13,14)
InChIKeyVNWZDZOJYRNKEH-UHFFFAOYSA-N
MW234.36 g/mol
LogP0.79
Rot. Bonds5

About 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide

3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide (PubChem CID 115608712) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide.

Molecular Properties

Compound Name3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide
PubChem CID115608712
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC Name3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide
SMILESCCC1CCCN(CCCS(N)(=O)=O)C1
InChIInChI=1S/C10H22N2O2S/c1-2-10-5-3-6-12(9-10)7-4-8-15(11,13)14/h10H,2-9H2,1H3,(H2,11,13,14)
InChIKeyVNWZDZOJYRNKEH-UHFFFAOYSA-N
XLogP0.79
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(aminomethyl)piperidin-1-yl]ethanesulfonamide
CID 114385443
3-ethyl-1-heptylpiperidine
CID 171569576
2-[(3R)-3-ethylpiperidin-1-yl]ethanamine
CID 93187820
N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine
CID 60867302
N-[3-(3-ethylpiperidin-1-yl)propyl]-2-methylpropan-2-amine
CID 60851535
4-(3-ethylpiperidin-1-yl)butan-2-amine
CID 43584476
1-(3-ethylpiperidin-1-yl)-4,4-dimethylpentan-3-amine
CID 62624076
6-(3-ethylpiperidin-1-yl)hexan-3-ol
CID 106802295
3-ethyl-1-hept-4-ynylpiperidine
CID 134581780
3-(3-ethylpiperidin-1-yl)propyl-trimethoxysilane
CID 19900960
3-(3,5-dimethylpiperidin-1-yl)propane-1-sulfonamide
CID 115608707
1-propylpiperidine-3-sulfonamide
CID 130991940

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide?
The IUPAC name of 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide (CID 115608712) is 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide.
What is the SMILES notation for 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide?
The canonical SMILES for 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide is CCC1CCCN(CCCS(N)(=O)=O)C1.
What is the InChIKey of 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide?
The InChIKey is VNWZDZOJYRNKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-2-10-5-3-6-12(9-10)7-4-8-15(11,13)14/h10H,2-9H2,1H3,(H2,11,13,14).
What are the key properties of 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide?
3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide has a molecular weight of 234.36 g/mol, XLogP of 0.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide is sourced from PubChem (CID 115608712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).