1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide

C11H20N2O4S — CID 20644288

IUPAC1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide
SMILESCC(C=O)NC(=O)C1(NS(C)(=O)=O)CCCCC1
InChIInChI=1S/C11H20N2O4S/c1-9(8-14)12-10(15)11(13-18(2,16)17)6-4-3-5-7-11/h8-9,13H,3-7H2,1-2H3,(H,12,15)
InChIKeyWUSDLSWBHRZOFA-UHFFFAOYSA-N
MW276.36 g/mol
LogP-0.06
Rot. Bonds5

About 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide

1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide (PubChem CID 20644288) has the molecular formula C11H20N2O4S and a molecular weight of 276.36 g/mol. Its IUPAC name is 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide
PubChem CID20644288
Molecular FormulaC11H20N2O4S
Molecular Weight276.36 g/mol
Exact Mass276.11
IUPAC Name1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide
SMILESCC(C=O)NC(=O)C1(NS(C)(=O)=O)CCCCC1
InChIInChI=1S/C11H20N2O4S/c1-9(8-14)12-10(15)11(13-18(2,16)17)6-4-3-5-7-11/h8-9,13H,3-7H2,1-2H3,(H,12,15)
InChIKeyWUSDLSWBHRZOFA-UHFFFAOYSA-N
XLogP-0.06
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 11066263
CID 11066263
CID 44381886
CID 44381886
CID 44367043
CID 44367043
CID 56759047
CID 56759047
CID 11521954
CID 11521954
CID 18421807
CID 18421807
CID 23383131
CID 23383131
CID 143504854
CID 143504854
CID 157963184
CID 157963184
CID 164083468
CID 164083468
CID 173062493
CID 173062493
CID 174849715
CID 174849715

Frequently Asked Questions

What is the IUPAC name of 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide?
The IUPAC name of 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide (CID 20644288) is 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide is CC(C=O)NC(=O)C1(NS(C)(=O)=O)CCCCC1.
What is the InChIKey of 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide?
The InChIKey is WUSDLSWBHRZOFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4S/c1-9(8-14)12-10(15)11(13-18(2,16)17)6-4-3-5-7-11/h8-9,13H,3-7H2,1-2H3,(H,12,15).
What are the key properties of 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide?
1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide has a molecular weight of 276.36 g/mol, XLogP of -0.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methanesulfonamido)-N-(1-oxopropan-2-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 20644288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).