N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide

C9H19NO3S — CID 61354708

IUPACN-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide
SMILESCOCCN(C1CC1)S(=O)(=O)C(C)C
InChIInChI=1S/C9H19NO3S/c1-8(2)14(11,12)10(6-7-13-3)9-4-5-9/h8-9H,4-7H2,1-3H3
InChIKeyYDYPGRAJSVJAIJ-UHFFFAOYSA-N
MW221.32 g/mol
LogP0.84
Rot. Bonds6

About N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide

N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide (PubChem CID 61354708) has the molecular formula C9H19NO3S and a molecular weight of 221.32 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide
PubChem CID61354708
Molecular FormulaC9H19NO3S
Molecular Weight221.32 g/mol
Exact Mass221.11
IUPAC NameN-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide
SMILESCOCCN(C1CC1)S(=O)(=O)C(C)C
InChIInChI=1S/C9H19NO3S/c1-8(2)14(11,12)10(6-7-13-3)9-4-5-9/h8-9H,4-7H2,1-3H3
InChIKeyYDYPGRAJSVJAIJ-UHFFFAOYSA-N
XLogP0.84
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide?
The IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide (CID 61354708) is N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide.
What is the SMILES notation for N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide?
The canonical SMILES for N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide is COCCN(C1CC1)S(=O)(=O)C(C)C.
What is the InChIKey of N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide?
The InChIKey is YDYPGRAJSVJAIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3S/c1-8(2)14(11,12)10(6-7-13-3)9-4-5-9/h8-9H,4-7H2,1-3H3.
What are the key properties of N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide?
N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide has a molecular weight of 221.32 g/mol, XLogP of 0.84, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methoxyethyl)propane-2-sulfonamide is sourced from PubChem (CID 61354708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).