N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide

C15H28N2O3S — CID 954161

IUPACN-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide
SMILESCC1CCN(C(=O)CN(C2CCCCC2)S(C)(=O)=O)CC1
InChIInChI=1S/C15H28N2O3S/c1-13-8-10-16(11-9-13)15(18)12-17(21(2,19)20)14-6-4-3-5-7-14/h13-14H,3-12H2,1-2H3
InChIKeyMZBTWIPNUVSTPE-UHFFFAOYSA-N
MW316.47 g/mol
LogP1.84
Rot. Bonds4

About N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide

N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide (PubChem CID 954161) has the molecular formula C15H28N2O3S and a molecular weight of 316.47 g/mol. Its IUPAC name is N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide
PubChem CID954161
Molecular FormulaC15H28N2O3S
Molecular Weight316.47 g/mol
Exact Mass316.18
IUPAC NameN-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide
SMILESCC1CCN(C(=O)CN(C2CCCCC2)S(C)(=O)=O)CC1
InChIInChI=1S/C15H28N2O3S/c1-13-8-10-16(11-9-13)15(18)12-17(21(2,19)20)14-6-4-3-5-7-14/h13-14H,3-12H2,1-2H3
InChIKeyMZBTWIPNUVSTPE-UHFFFAOYSA-N
XLogP1.84
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.47
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide?
The IUPAC name of N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide (CID 954161) is N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide.
What is the SMILES notation for N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide?
The canonical SMILES for N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide is CC1CCN(C(=O)CN(C2CCCCC2)S(C)(=O)=O)CC1.
What is the InChIKey of N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide?
The InChIKey is MZBTWIPNUVSTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3S/c1-13-8-10-16(11-9-13)15(18)12-17(21(2,19)20)14-6-4-3-5-7-14/h13-14H,3-12H2,1-2H3.
What are the key properties of N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide?
N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide has a molecular weight of 316.47 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide is sourced from PubChem (CID 954161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).