1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide

C18H35N3O3S — CID 4134017

IUPAC1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)N1CCC(C(=O)NC2CCCC(C)C2C)CC1
InChIInChI=1S/C18H35N3O3S/c1-5-20(6-2)25(23,24)21-12-10-16(11-13-21)18(22)19-17-9-7-8-14(3)15(17)4/h14-17H,5-13H2,1-4H3,(H,19,22)
InChIKeySOXLXGYUNDVKSW-UHFFFAOYSA-N
MW373.56 g/mol
LogP2.23
Rot. Bonds6

About 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide

1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide (PubChem CID 4134017) has the molecular formula C18H35N3O3S and a molecular weight of 373.56 g/mol. Its IUPAC name is 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide
PubChem CID4134017
Molecular FormulaC18H35N3O3S
Molecular Weight373.56 g/mol
Exact Mass373.24
IUPAC Name1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)N1CCC(C(=O)NC2CCCC(C)C2C)CC1
InChIInChI=1S/C18H35N3O3S/c1-5-20(6-2)25(23,24)21-12-10-16(11-13-21)18(22)19-17-9-7-8-14(3)15(17)4/h14-17H,5-13H2,1-4H3,(H,19,22)
InChIKeySOXLXGYUNDVKSW-UHFFFAOYSA-N
XLogP2.23
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.56
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide?
The IUPAC name of 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide (CID 4134017) is 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide is CCN(CC)S(=O)(=O)N1CCC(C(=O)NC2CCCC(C)C2C)CC1.
What is the InChIKey of 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide?
The InChIKey is SOXLXGYUNDVKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3O3S/c1-5-20(6-2)25(23,24)21-12-10-16(11-13-21)18(22)19-17-9-7-8-14(3)15(17)4/h14-17H,5-13H2,1-4H3,(H,19,22).
What are the key properties of 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide?
1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide has a molecular weight of 373.56 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide is sourced from PubChem (CID 4134017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).