N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide

C14H25N3O2S — CID 61124093

IUPACN-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide
SMILESCCC1CCC(C#N)(NS(=O)(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H25N3O2S/c1-2-13-6-8-14(12-15,9-7-13)16-20(18,19)17-10-4-3-5-11-17/h13,16H,2-11H2,1H3
InChIKeyVQUDMJLWEWPCND-UHFFFAOYSA-N
MW299.44 g/mol
LogP2.17
Rot. Bonds4

About N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide

N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide (PubChem CID 61124093) has the molecular formula C14H25N3O2S and a molecular weight of 299.44 g/mol. Its IUPAC name is N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide
PubChem CID61124093
Molecular FormulaC14H25N3O2S
Molecular Weight299.44 g/mol
Exact Mass299.17
IUPAC NameN-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide
SMILESCCC1CCC(C#N)(NS(=O)(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H25N3O2S/c1-2-13-6-8-14(12-15,9-7-13)16-20(18,19)17-10-4-3-5-11-17/h13,16H,2-11H2,1H3
InChIKeyVQUDMJLWEWPCND-UHFFFAOYSA-N
XLogP2.17
TPSA73.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.44
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)-4-methylcyclohexyl]-4-methylpiperidine-1-sulfonamide
CID 28940700
N-[1-(aminomethyl)-4-methylcyclohexyl]piperidine-1-sulfonamide
CID 28940702
N-[1-(aminomethyl)-4-ethylcyclohexyl]-4-methylpiperidine-1-sulfonamide
CID 28940740
N-[1-(aminomethyl)-4-ethylcyclohexyl]piperidine-1-sulfonamide
CID 28940742
N-[1-(aminomethyl)-4-methylcyclohexyl]-3-methylpiperidine-1-sulfonamide
CID 43119830
N-[1-(aminomethyl)-4-ethylcyclohexyl]-2-methylpiperidine-1-sulfonamide
CID 43119837
N-[1-(aminomethyl)-4-ethylcyclohexyl]-3-methylpiperidine-1-sulfonamide
CID 43119838
1-Cyano-4-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane
CID 54947883
N-(1-cyanocyclohexyl)piperidine-1-sulfonamide
CID 60723801
N-(1-cyanocyclohexyl)-4-methylpiperidine-1-sulfonamide
CID 60728775
N-(1-cyano-4-ethylcyclohexyl)-4-methylpiperidine-1-sulfonamide
CID 61121904
N-(1-cyano-4-methylcyclohexyl)-2-methylpiperidine-1-sulfonamide
CID 61122093

Frequently Asked Questions

What is the IUPAC name of N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide?
The IUPAC name of N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide (CID 61124093) is N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide?
The canonical SMILES for N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide is CCC1CCC(C#N)(NS(=O)(=O)N2CCCCC2)CC1.
What is the InChIKey of N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide?
The InChIKey is VQUDMJLWEWPCND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2S/c1-2-13-6-8-14(12-15,9-7-13)16-20(18,19)17-10-4-3-5-11-17/h13,16H,2-11H2,1H3.
What are the key properties of N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide?
N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide has a molecular weight of 299.44 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyano-4-ethylcyclohexyl)piperidine-1-sulfonamide is sourced from PubChem (CID 61124093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).