3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine

C10H19NO4S — CID 107758120

IUPAC3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine
SMILESCC1OCCC1S(=O)(=O)C1COCCC1N
InChIInChI=1S/C10H19NO4S/c1-7-9(3-5-15-7)16(12,13)10-6-14-4-2-8(10)11/h7-10H,2-6,11H2,1H3
InChIKeyYJJYGXSGWGKZRO-UHFFFAOYSA-N
MW249.33 g/mol
LogP-0.31
Rot. Bonds2

About 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine

3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine (PubChem CID 107758120) has the molecular formula C10H19NO4S and a molecular weight of 249.33 g/mol. Its IUPAC name is 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine.

Molecular Properties

Compound Name3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine
PubChem CID107758120
Molecular FormulaC10H19NO4S
Molecular Weight249.33 g/mol
Exact Mass249.10
IUPAC Name3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine
SMILESCC1OCCC1S(=O)(=O)C1COCCC1N
InChIInChI=1S/C10H19NO4S/c1-7-9(3-5-15-7)16(12,13)10-6-14-4-2-8(10)11/h7-10H,2-6,11H2,1H3
InChIKeyYJJYGXSGWGKZRO-UHFFFAOYSA-N
XLogP-0.31
TPSA78.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3S)-2-methyloxolane-3-sulfonyl chloride
CID 98113530
2-methyloxolane-3-sulfonyl fluoride
CID 165460627
(3S,4R)-3-methyloxane-4-sulfonamide
CID 97177290
3-(chloromethylsulfonyl)-2-methyloxolane
CID 107746968
N-methyl-2-(2-methyloxolan-3-yl)sulfonyl-1-(oxolan-3-yl)ethanamine
CID 107758127
3-ethenylsulfonyl-2-methyloxolane
CID 107746971
2-methyl-3-(2-methyloxolan-3-yl)sulfonyl-N-propylcyclopentan-1-amine
CID 107758146
2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide
CID 114232726
4-(2-methyloxolan-3-yl)sulfonylbutan-1-amine
CID 107756941
4-(2-methyloxolan-3-yl)sulfonylpentan-2-amine
CID 107758142
2-(oxan-4-ylsulfonyl)cycloheptan-1-amine
CID 64675294
(3S,4S)-3-methyloxane-4-sulfonyl chloride
CID 98084898

Frequently Asked Questions

What is the IUPAC name of 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine?
The IUPAC name of 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine (CID 107758120) is 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine.
What is the SMILES notation for 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine?
The canonical SMILES for 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine is CC1OCCC1S(=O)(=O)C1COCCC1N.
What is the InChIKey of 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine?
The InChIKey is YJJYGXSGWGKZRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO4S/c1-7-9(3-5-15-7)16(12,13)10-6-14-4-2-8(10)11/h7-10H,2-6,11H2,1H3.
What are the key properties of 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine?
3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine has a molecular weight of 249.33 g/mol, XLogP of -0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine is sourced from PubChem (CID 107758120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).