N-cyclohexylpropane-2-sulfonamide

C9H19NO2S — CID 13053802

IUPACN-cyclohexylpropane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C9H19NO2S/c1-8(2)13(11,12)10-9-6-4-3-5-7-9/h8-10H,3-7H2,1-2H3
InChIKeyWDKYUMYXXKGAON-UHFFFAOYSA-N
MW205.32 g/mol
LogP1.65
Rot. Bonds3

About N-cyclohexylpropane-2-sulfonamide

N-cyclohexylpropane-2-sulfonamide (PubChem CID 13053802) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is N-cyclohexylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-cyclohexylpropane-2-sulfonamide
PubChem CID13053802
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC NameN-cyclohexylpropane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C9H19NO2S/c1-8(2)13(11,12)10-9-6-4-3-5-7-9/h8-10H,3-7H2,1-2H3
InChIKeyWDKYUMYXXKGAON-UHFFFAOYSA-N
XLogP1.65
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexylpropane-2-sulfonamide?
The IUPAC name of N-cyclohexylpropane-2-sulfonamide (CID 13053802) is N-cyclohexylpropane-2-sulfonamide.
What is the SMILES notation for N-cyclohexylpropane-2-sulfonamide?
The canonical SMILES for N-cyclohexylpropane-2-sulfonamide is CC(C)S(=O)(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexylpropane-2-sulfonamide?
The InChIKey is WDKYUMYXXKGAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-8(2)13(11,12)10-9-6-4-3-5-7-9/h8-10H,3-7H2,1-2H3.
What are the key properties of N-cyclohexylpropane-2-sulfonamide?
N-cyclohexylpropane-2-sulfonamide has a molecular weight of 205.32 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylpropane-2-sulfonamide is sourced from PubChem (CID 13053802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).