2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide

C14H20N2O3S — CID 43266727

IUPAC2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide
SMILESCCC1CCCCN1C(=O)c1ccccc1S(N)(=O)=O
InChIInChI=1S/C14H20N2O3S/c1-2-11-7-5-6-10-16(11)14(17)12-8-3-4-9-13(12)20(15,18)19/h3-4,8-9,11H,2,5-7,10H2,1H3,(H2,15,18,19)
InChIKeyQUJQJUDDGPSCGB-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.74
Rot. Bonds3

About 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide

2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide (PubChem CID 43266727) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide.

Molecular Properties

Compound Name2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide
PubChem CID43266727
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC Name2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide
SMILESCCC1CCCCN1C(=O)c1ccccc1S(N)(=O)=O
InChIInChI=1S/C14H20N2O3S/c1-2-11-7-5-6-10-16(11)14(17)12-8-3-4-9-13(12)20(15,18)19/h3-4,8-9,11H,2,5-7,10H2,1H3,(H2,15,18,19)
InChIKeyQUJQJUDDGPSCGB-UHFFFAOYSA-N
XLogP1.74
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-ethylazepan-1-yl)-(2-hydroxyphenyl)methanone
CID 112692526
3-chloro-2-(2-ethylpyrrolidine-1-carbonyl)benzenesulfonamide
CID 63661655
(2-ethylsulfonylphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
CID 43421223
5-[(2R)-2-ethylpiperidine-1-carbonyl]-2,4-dimethylbenzenesulfonamide
CID 95382756
[2-(ethylamino)phenyl]-(2-ethylazepan-1-yl)methanone
CID 104690846
(2-ethylpyrrolidin-1-yl)-(2-methylphenyl)methanone
CID 110604637
[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1087323
(2-ethylpiperidin-1-yl)-(3-hydroxynaphthalen-2-yl)methanone
CID 43403986
(2-ethylpyrrolidin-1-yl)-(2-iodophenyl)methanone
CID 55137776
3-(2-ethylpyrrolidine-1-carbonyl)benzenesulfonamide
CID 54885699
(2-ethylpyrrolidin-1-yl)-phenylmethanone
CID 20577009
(2-hydroxyphenyl)-(2-propylpiperidin-1-yl)methanone
CID 83056508

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide?
The IUPAC name of 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide (CID 43266727) is 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide.
What is the SMILES notation for 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide?
The canonical SMILES for 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide is CCC1CCCCN1C(=O)c1ccccc1S(N)(=O)=O.
What is the InChIKey of 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide?
The InChIKey is QUJQJUDDGPSCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-2-11-7-5-6-10-16(11)14(17)12-8-3-4-9-13(12)20(15,18)19/h3-4,8-9,11H,2,5-7,10H2,1H3,(H2,15,18,19).
What are the key properties of 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide?
2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide has a molecular weight of 296.39 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide is sourced from PubChem (CID 43266727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).