N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride

C10H21ClN2O3S — CID 119317688

IUPACN-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride
SMILESCCS(=O)(=O)CCNC(=O)C1CCCNC1.Cl
InChIInChI=1S/C10H20N2O3S.ClH/c1-2-16(14,15)7-6-12-10(13)9-4-3-5-11-8-9;/h9,11H,2-8H2,1H3,(H,12,13);1H
InChIKeySYWXKLXRVULKSL-UHFFFAOYSA-N
MW284.81 g/mol
LogP-0.04
Rot. Bonds5

About N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride

N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119317688) has the molecular formula C10H21ClN2O3S and a molecular weight of 284.81 g/mol. Its IUPAC name is N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride
PubChem CID119317688
Molecular FormulaC10H21ClN2O3S
Molecular Weight284.81 g/mol
Exact Mass284.10
IUPAC NameN-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride
SMILESCCS(=O)(=O)CCNC(=O)C1CCCNC1.Cl
InChIInChI=1S/C10H20N2O3S.ClH/c1-2-16(14,15)7-6-12-10(13)9-4-3-5-11-8-9;/h9,11H,2-8H2,1H3,(H,12,13);1H
InChIKeySYWXKLXRVULKSL-UHFFFAOYSA-N
XLogP-0.04
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.81
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
(3S)-N-(3-methylsulfonylpropyl)piperidine-3-carboxamide
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CID 166001356
N-[3-[ethylsulfonyl(methyl)amino]propyl]piperidine-3-carboxamide;hydrochloride
CID 119292349
N-[3-(4-ethylpiperazin-1-yl)propyl]piperidine-3-carboxamide;trihydrochloride
CID 119901823
N-(3-methylsulfanylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119280390
(3S)-N-[2-[ethyl(methyl)amino]ethyl]piperidine-3-carboxamide
CID 81140340
N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-3-carboxamide
CID 106337238
(3S)-N-[2-(dimethylcarbamoylamino)ethyl]piperidine-3-carboxamide
CID 83111640
(3R)-N-(3-butoxypropyl)piperidine-3-carboxamide
CID 113481104
N-[3-(azepan-1-yl)propyl]piperidine-3-carboxamide;dihydrochloride
CID 119831193
(3S)-N-[3-(diethylamino)-3-oxopropyl]piperidine-3-carboxamide
CID 81124971

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride (CID 119317688) is N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride is CCS(=O)(=O)CCNC(=O)C1CCCNC1.Cl.
What is the InChIKey of N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is SYWXKLXRVULKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3S.ClH/c1-2-16(14,15)7-6-12-10(13)9-4-3-5-11-8-9;/h9,11H,2-8H2,1H3,(H,12,13);1H.
What are the key properties of N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride?
N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 284.81 g/mol, XLogP of -0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119317688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).