1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide

C10H21NO2S — CID 115673529

IUPAC1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide
SMILESCCC(CC)CNS(=O)(=O)CC1CC1
InChIInChI=1S/C10H21NO2S/c1-3-9(4-2)7-11-14(12,13)8-10-5-6-10/h9-11H,3-8H2,1-2H3
InChIKeyMTMQHWARQSEULL-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.75
Rot. Bonds7

About 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide

1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide (PubChem CID 115673529) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide.

Molecular Properties

Compound Name1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide
PubChem CID115673529
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC Name1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide
SMILESCCC(CC)CNS(=O)(=O)CC1CC1
InChIInChI=1S/C10H21NO2S/c1-3-9(4-2)7-11-14(12,13)8-10-5-6-10/h9-11H,3-8H2,1-2H3
InChIKeyMTMQHWARQSEULL-UHFFFAOYSA-N
XLogP1.75
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide 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 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide?
The IUPAC name of 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide (CID 115673529) is 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide.
What is the SMILES notation for 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide?
The canonical SMILES for 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide is CCC(CC)CNS(=O)(=O)CC1CC1.
What is the InChIKey of 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide?
The InChIKey is MTMQHWARQSEULL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-3-9(4-2)7-11-14(12,13)8-10-5-6-10/h9-11H,3-8H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide?
1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide has a molecular weight of 219.35 g/mol, XLogP of 1.75, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(2-ethylbutyl)methanesulfonamide is sourced from PubChem (CID 115673529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).