[5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine

C11H18N2O3S2 — CID 43593138

IUPAC[5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine
SMILESCC1(C)CN(S(=O)(=O)c2ccc(CN)s2)CCO1
InChIInChI=1S/C11H18N2O3S2/c1-11(2)8-13(5-6-16-11)18(14,15)10-4-3-9(7-12)17-10/h3-4H,5-8,12H2,1-2H3
InChIKeyDYLGYLWABCBTRF-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.01
Rot. Bonds3

About [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine

[5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine (PubChem CID 43593138) has the molecular formula C11H18N2O3S2 and a molecular weight of 290.41 g/mol. Its IUPAC name is [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine.

Molecular Properties

Compound Name[5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine
PubChem CID43593138
Molecular FormulaC11H18N2O3S2
Molecular Weight290.41 g/mol
Exact Mass290.08
IUPAC Name[5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine
SMILESCC1(C)CN(S(=O)(=O)c2ccc(CN)s2)CCO1
InChIInChI=1S/C11H18N2O3S2/c1-11(2)8-13(5-6-16-11)18(14,15)10-4-3-9(7-12)17-10/h3-4H,5-8,12H2,1-2H3
InChIKeyDYLGYLWABCBTRF-UHFFFAOYSA-N
XLogP1.01
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine?
The IUPAC name of [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine (CID 43593138) is [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine.
What is the SMILES notation for [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine?
The canonical SMILES for [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine is CC1(C)CN(S(=O)(=O)c2ccc(CN)s2)CCO1.
What is the InChIKey of [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine?
The InChIKey is DYLGYLWABCBTRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S2/c1-11(2)8-13(5-6-16-11)18(14,15)10-4-3-9(7-12)17-10/h3-4H,5-8,12H2,1-2H3.
What are the key properties of [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine?
[5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine has a molecular weight of 290.41 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,2-dimethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine is sourced from PubChem (CID 43593138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).