1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride

C7H14ClNO4S2 — CID 165490337

IUPAC1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride
SMILESCN(CCC1(S(=O)(=O)Cl)CC1)S(C)(=O)=O
InChIInChI=1S/C7H14ClNO4S2/c1-9(14(2,10)11)6-5-7(3-4-7)15(8,12)13/h3-6H2,1-2H3
InChIKeyQOVUDXWKHQXVKR-UHFFFAOYSA-N
MW275.78 g/mol
LogP0.37
Rot. Bonds5

About 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride

1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride (PubChem CID 165490337) has the molecular formula C7H14ClNO4S2 and a molecular weight of 275.78 g/mol. Its IUPAC name is 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride.

Molecular Properties

Compound Name1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride
PubChem CID165490337
Molecular FormulaC7H14ClNO4S2
Molecular Weight275.78 g/mol
Exact Mass275.01
IUPAC Name1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride
SMILESCN(CCC1(S(=O)(=O)Cl)CC1)S(C)(=O)=O
InChIInChI=1S/C7H14ClNO4S2/c1-9(14(2,10)11)6-5-7(3-4-7)15(8,12)13/h3-6H2,1-2H3
InChIKeyQOVUDXWKHQXVKR-UHFFFAOYSA-N
XLogP0.37
TPSA71.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.78
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride?
The IUPAC name of 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride (CID 165490337) is 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride.
What is the SMILES notation for 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride?
The canonical SMILES for 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride is CN(CCC1(S(=O)(=O)Cl)CC1)S(C)(=O)=O.
What is the InChIKey of 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride?
The InChIKey is QOVUDXWKHQXVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14ClNO4S2/c1-9(14(2,10)11)6-5-7(3-4-7)15(8,12)13/h3-6H2,1-2H3.
What are the key properties of 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride?
1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride has a molecular weight of 275.78 g/mol, XLogP of 0.37, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[methyl(methylsulfonyl)amino]ethyl]cyclopropane-1-sulfonyl chloride is sourced from PubChem (CID 165490337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).