N-butan-2-ylcyclohexanesulfonamide

C10H21NO2S — CID 63362858

IUPACN-butan-2-ylcyclohexanesulfonamide
SMILESCCC(C)NS(=O)(=O)C1CCCCC1
InChIInChI=1S/C10H21NO2S/c1-3-9(2)11-14(12,13)10-7-5-4-6-8-10/h9-11H,3-8H2,1-2H3
InChIKeyFAXPGRXCRJMWNG-UHFFFAOYSA-N
MW219.35 g/mol
LogP2.04
Rot. Bonds4

About N-butan-2-ylcyclohexanesulfonamide

N-butan-2-ylcyclohexanesulfonamide (PubChem CID 63362858) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is N-butan-2-ylcyclohexanesulfonamide.

Molecular Properties

Compound NameN-butan-2-ylcyclohexanesulfonamide
PubChem CID63362858
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC NameN-butan-2-ylcyclohexanesulfonamide
SMILESCCC(C)NS(=O)(=O)C1CCCCC1
InChIInChI=1S/C10H21NO2S/c1-3-9(2)11-14(12,13)10-7-5-4-6-8-10/h9-11H,3-8H2,1-2H3
InChIKeyFAXPGRXCRJMWNG-UHFFFAOYSA-N
XLogP2.04
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-ylcyclohexanesulfonamide?
The IUPAC name of N-butan-2-ylcyclohexanesulfonamide (CID 63362858) is N-butan-2-ylcyclohexanesulfonamide.
What is the SMILES notation for N-butan-2-ylcyclohexanesulfonamide?
The canonical SMILES for N-butan-2-ylcyclohexanesulfonamide is CCC(C)NS(=O)(=O)C1CCCCC1.
What is the InChIKey of N-butan-2-ylcyclohexanesulfonamide?
The InChIKey is FAXPGRXCRJMWNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-3-9(2)11-14(12,13)10-7-5-4-6-8-10/h9-11H,3-8H2,1-2H3.
What are the key properties of N-butan-2-ylcyclohexanesulfonamide?
N-butan-2-ylcyclohexanesulfonamide has a molecular weight of 219.35 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-ylcyclohexanesulfonamide is sourced from PubChem (CID 63362858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).