N,N-dicyclohexylmethanesulfonamide

C13H25NO2S — CID 3475883

IUPACN,N-dicyclohexylmethanesulfonamide
SMILESCS(=O)(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C13H25NO2S/c1-17(15,16)14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h12-13H,2-11H2,1H3
InChIKeyKQLDGOIRMCDFJY-UHFFFAOYSA-N
MW259.41 g/mol
LogP2.91
Rot. Bonds3

About N,N-dicyclohexylmethanesulfonamide

N,N-dicyclohexylmethanesulfonamide (PubChem CID 3475883) has the molecular formula C13H25NO2S and a molecular weight of 259.41 g/mol. Its IUPAC name is N,N-dicyclohexylmethanesulfonamide.

Molecular Properties

Compound NameN,N-dicyclohexylmethanesulfonamide
PubChem CID3475883
Molecular FormulaC13H25NO2S
Molecular Weight259.41 g/mol
Exact Mass259.16
IUPAC NameN,N-dicyclohexylmethanesulfonamide
SMILESCS(=O)(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C13H25NO2S/c1-17(15,16)14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h12-13H,2-11H2,1H3
InChIKeyKQLDGOIRMCDFJY-UHFFFAOYSA-N
XLogP2.91
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.41
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexylmethanesulfonamide?
The IUPAC name of N,N-dicyclohexylmethanesulfonamide (CID 3475883) is N,N-dicyclohexylmethanesulfonamide.
What is the SMILES notation for N,N-dicyclohexylmethanesulfonamide?
The canonical SMILES for N,N-dicyclohexylmethanesulfonamide is CS(=O)(=O)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexylmethanesulfonamide?
The InChIKey is KQLDGOIRMCDFJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2S/c1-17(15,16)14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h12-13H,2-11H2,1H3.
What are the key properties of N,N-dicyclohexylmethanesulfonamide?
N,N-dicyclohexylmethanesulfonamide has a molecular weight of 259.41 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexylmethanesulfonamide is sourced from PubChem (CID 3475883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).