N-(cyclohexylmethyl)butane-1-sulfonamide

C11H23NO2S — CID 19684283

IUPACN-(cyclohexylmethyl)butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NCC1CCCCC1
InChIInChI=1S/C11H23NO2S/c1-2-3-9-15(13,14)12-10-11-7-5-4-6-8-11/h11-12H,2-10H2,1H3
InChIKeyDWYXLPGZXHILGI-UHFFFAOYSA-N
MW233.38 g/mol
LogP2.29
Rot. Bonds6

About N-(cyclohexylmethyl)butane-1-sulfonamide

N-(cyclohexylmethyl)butane-1-sulfonamide (PubChem CID 19684283) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is N-(cyclohexylmethyl)butane-1-sulfonamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)butane-1-sulfonamide
PubChem CID19684283
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC NameN-(cyclohexylmethyl)butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NCC1CCCCC1
InChIInChI=1S/C11H23NO2S/c1-2-3-9-15(13,14)12-10-11-7-5-4-6-8-11/h11-12H,2-10H2,1H3
InChIKeyDWYXLPGZXHILGI-UHFFFAOYSA-N
XLogP2.29
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)butane-1-sulfonamide?
The IUPAC name of N-(cyclohexylmethyl)butane-1-sulfonamide (CID 19684283) is N-(cyclohexylmethyl)butane-1-sulfonamide.
What is the SMILES notation for N-(cyclohexylmethyl)butane-1-sulfonamide?
The canonical SMILES for N-(cyclohexylmethyl)butane-1-sulfonamide is CCCCS(=O)(=O)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)butane-1-sulfonamide?
The InChIKey is DWYXLPGZXHILGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-2-3-9-15(13,14)12-10-11-7-5-4-6-8-11/h11-12H,2-10H2,1H3.
What are the key properties of N-(cyclohexylmethyl)butane-1-sulfonamide?
N-(cyclohexylmethyl)butane-1-sulfonamide has a molecular weight of 233.38 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)butane-1-sulfonamide is sourced from PubChem (CID 19684283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).