N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide

C14H27NO2S — CID 58395102

IUPACN-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide
SMILESCN(C1CCC(C(C)(C)C)CC1)S(=O)(=O)C1CC1
InChIInChI=1S/C14H27NO2S/c1-14(2,3)11-5-7-12(8-6-11)15(4)18(16,17)13-9-10-13/h11-13H,5-10H2,1-4H3
InChIKeyMTCVUEBCYVORMA-UHFFFAOYSA-N
MW273.44 g/mol
LogP3.02
Rot. Bonds3

About N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide

N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide (PubChem CID 58395102) has the molecular formula C14H27NO2S and a molecular weight of 273.44 g/mol. Its IUPAC name is N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide.

Molecular Properties

Compound NameN-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide
PubChem CID58395102
Molecular FormulaC14H27NO2S
Molecular Weight273.44 g/mol
Exact Mass273.18
IUPAC NameN-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide
SMILESCN(C1CCC(C(C)(C)C)CC1)S(=O)(=O)C1CC1
InChIInChI=1S/C14H27NO2S/c1-14(2,3)11-5-7-12(8-6-11)15(4)18(16,17)13-9-10-13/h11-13H,5-10H2,1-4H3
InChIKeyMTCVUEBCYVORMA-UHFFFAOYSA-N
XLogP3.02
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.44
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide?
The IUPAC name of N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide (CID 58395102) is N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide.
What is the SMILES notation for N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide?
The canonical SMILES for N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide is CN(C1CCC(C(C)(C)C)CC1)S(=O)(=O)C1CC1.
What is the InChIKey of N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide?
The InChIKey is MTCVUEBCYVORMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2S/c1-14(2,3)11-5-7-12(8-6-11)15(4)18(16,17)13-9-10-13/h11-13H,5-10H2,1-4H3.
What are the key properties of N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide?
N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide has a molecular weight of 273.44 g/mol, XLogP of 3.02, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylcyclohexyl)-N-methylcyclopropanesulfonamide is sourced from PubChem (CID 58395102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).