N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide

C10H19NO3S — CID 59945947

IUPACN-(1-cyclohexyl-2-oxopropyl)methanesulfonamide
SMILESCC(=O)C(NS(C)(=O)=O)C1CCCCC1
InChIInChI=1S/C10H19NO3S/c1-8(12)10(11-15(2,13)14)9-6-4-3-5-7-9/h9-11H,3-7H2,1-2H3
InChIKeyOWPGFIVMWPNVRR-UHFFFAOYSA-N
MW233.33 g/mol
LogP1.07
Rot. Bonds4

About N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide

N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide (PubChem CID 59945947) has the molecular formula C10H19NO3S and a molecular weight of 233.33 g/mol. Its IUPAC name is N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide.

Molecular Properties

Compound NameN-(1-cyclohexyl-2-oxopropyl)methanesulfonamide
PubChem CID59945947
Molecular FormulaC10H19NO3S
Molecular Weight233.33 g/mol
Exact Mass233.11
IUPAC NameN-(1-cyclohexyl-2-oxopropyl)methanesulfonamide
SMILESCC(=O)C(NS(C)(=O)=O)C1CCCCC1
InChIInChI=1S/C10H19NO3S/c1-8(12)10(11-15(2,13)14)9-6-4-3-5-7-9/h9-11H,3-7H2,1-2H3
InChIKeyOWPGFIVMWPNVRR-UHFFFAOYSA-N
XLogP1.07
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

trifluoro-N-(1-(4-oxocyclohexyl)propyl)methanesulfonamide
CID 68003419
1,1,1-trifluoro-N-[3-(4-oxocyclohexyl)propyl]methanesulfonamide
CID 68003420
N-[(2-oxocyclohexyl)methyl]methanesulfonamide
CID 134896116
N-[2-[4-oxocyclohexyl]propyl] 2-propanesulfonamide
CID 15489190
N-[(2S,5S)-5-amino-6-cyclohexyl-4-oxo-2-propan-2-ylhexyl]propane-1-sulfonamide
CID 15735163
N-(1-cyclohexyl-3-oxopropan-2-yl)methanesulfonamide
CID 17800327
N-[2-methyl-2-(4-oxocyclohexyl)propyl]methanesulfonamide
CID 18714022
N-[2-[4-oxocyclohexyl]ethyl] 2-propanesulfonamide
CID 22624691
2-Amino-1-cyclohexyl-5-methyl-3-oxohexane-1-sulfinic acid
CID 57043858
[(2S)-2-(sulfinatoamino)propanoyl]cyclohexane
CID 57158833
N-(1-(4-oxocyclohexyl)propyl)methanesulfonamide
CID 58562881
N-(4-acetylcyclohexyl)methanesulfonamide
CID 58664350

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide?
The IUPAC name of N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide (CID 59945947) is N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide.
What is the SMILES notation for N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide?
The canonical SMILES for N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide is CC(=O)C(NS(C)(=O)=O)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide?
The InChIKey is OWPGFIVMWPNVRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3S/c1-8(12)10(11-15(2,13)14)9-6-4-3-5-7-9/h9-11H,3-7H2,1-2H3.
What are the key properties of N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide?
N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide has a molecular weight of 233.33 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexyl-2-oxopropyl)methanesulfonamide is sourced from PubChem (CID 59945947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).