1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide

C12H24N2O2S — CID 79122184

IUPAC1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide
SMILESCNC1CCC(N(C)S(=O)(=O)CC2CC2)CC1
InChIInChI=1S/C12H24N2O2S/c1-13-11-5-7-12(8-6-11)14(2)17(15,16)9-10-3-4-10/h10-13H,3-9H2,1-2H3
InChIKeyDZAFHDFEVXGLMY-UHFFFAOYSA-N
MW260.40 g/mol
LogP1.19
Rot. Bonds5

About 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide

1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide (PubChem CID 79122184) has the molecular formula C12H24N2O2S and a molecular weight of 260.40 g/mol. Its IUPAC name is 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide
PubChem CID79122184
Molecular FormulaC12H24N2O2S
Molecular Weight260.40 g/mol
Exact Mass260.16
IUPAC Name1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide
SMILESCNC1CCC(N(C)S(=O)(=O)CC2CC2)CC1
InChIInChI=1S/C12H24N2O2S/c1-13-11-5-7-12(8-6-11)14(2)17(15,16)9-10-3-4-10/h10-13H,3-9H2,1-2H3
InChIKeyDZAFHDFEVXGLMY-UHFFFAOYSA-N
XLogP1.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.40
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide?
The IUPAC name of 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide (CID 79122184) is 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide.
What is the SMILES notation for 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide?
The canonical SMILES for 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide is CNC1CCC(N(C)S(=O)(=O)CC2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide?
The InChIKey is DZAFHDFEVXGLMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2S/c1-13-11-5-7-12(8-6-11)14(2)17(15,16)9-10-3-4-10/h10-13H,3-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide?
1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide has a molecular weight of 260.40 g/mol, XLogP of 1.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methyl-N-[4-(methylamino)cyclohexyl]methanesulfonamide is sourced from PubChem (CID 79122184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).