1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide

C11H23NO4S — CID 54947526

IUPAC1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide
SMILESO=S(=O)(CC1CCCCC1)N(CCO)CCO
InChIInChI=1S/C11H23NO4S/c13-8-6-12(7-9-14)17(15,16)10-11-4-2-1-3-5-11/h11,13-14H,1-10H2
InChIKeyAJNCGFSIMZIKBY-UHFFFAOYSA-N
MW265.37 g/mol
LogP0.18
Rot. Bonds7

About 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide

1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide (PubChem CID 54947526) has the molecular formula C11H23NO4S and a molecular weight of 265.37 g/mol. Its IUPAC name is 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide.

Molecular Properties

Compound Name1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide
PubChem CID54947526
Molecular FormulaC11H23NO4S
Molecular Weight265.37 g/mol
Exact Mass265.13
IUPAC Name1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide
SMILESO=S(=O)(CC1CCCCC1)N(CCO)CCO
InChIInChI=1S/C11H23NO4S/c13-8-6-12(7-9-14)17(15,16)10-11-4-2-1-3-5-11/h11,13-14H,1-10H2
InChIKeyAJNCGFSIMZIKBY-UHFFFAOYSA-N
XLogP0.18
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide?
The IUPAC name of 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide (CID 54947526) is 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide.
What is the SMILES notation for 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide?
The canonical SMILES for 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide is O=S(=O)(CC1CCCCC1)N(CCO)CCO.
What is the InChIKey of 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide?
The InChIKey is AJNCGFSIMZIKBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO4S/c13-8-6-12(7-9-14)17(15,16)10-11-4-2-1-3-5-11/h11,13-14H,1-10H2.
What are the key properties of 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide?
1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide has a molecular weight of 265.37 g/mol, XLogP of 0.18, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide is sourced from PubChem (CID 54947526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).