1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine

C10H19NO3S — CID 107758059

IUPAC1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine
SMILESCC1OCCC1S(=O)(=O)CC(N)C1CC1
InChIInChI=1S/C10H19NO3S/c1-7-10(4-5-14-7)15(12,13)6-9(11)8-2-3-8/h7-10H,2-6,11H2,1H3
InChIKeyLCRDYIZQUVQRGK-UHFFFAOYSA-N
MW233.33 g/mol
LogP0.32
Rot. Bonds4

About 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine

1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine (PubChem CID 107758059) has the molecular formula C10H19NO3S and a molecular weight of 233.33 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine
PubChem CID107758059
Molecular FormulaC10H19NO3S
Molecular Weight233.33 g/mol
Exact Mass233.11
IUPAC Name1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine
SMILESCC1OCCC1S(=O)(=O)CC(N)C1CC1
InChIInChI=1S/C10H19NO3S/c1-7-10(4-5-14-7)15(12,13)6-9(11)8-2-3-8/h7-10H,2-6,11H2,1H3
InChIKeyLCRDYIZQUVQRGK-UHFFFAOYSA-N
XLogP0.32
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine?
The IUPAC name of 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine (CID 107758059) is 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine.
What is the SMILES notation for 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine?
The canonical SMILES for 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine is CC1OCCC1S(=O)(=O)CC(N)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine?
The InChIKey is LCRDYIZQUVQRGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3S/c1-7-10(4-5-14-7)15(12,13)6-9(11)8-2-3-8/h7-10H,2-6,11H2,1H3.
What are the key properties of 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine?
1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine has a molecular weight of 233.33 g/mol, XLogP of 0.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2-methyloxolan-3-yl)sulfonylethanamine is sourced from PubChem (CID 107758059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).