N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine

C11H18N2OS — CID 79916136

IUPACN-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine
SMILESCNCc1nc2c(s1)C(C)(C)OC2(C)C
InChIInChI=1S/C11H18N2OS/c1-10(2)8-9(11(3,4)14-10)15-7(13-8)6-12-5/h12H,6H2,1-5H3
InChIKeyYYICYUIYEOPGMR-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.36
Rot. Bonds2

About N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine

N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine (PubChem CID 79916136) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine
PubChem CID79916136
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC NameN-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine
SMILESCNCc1nc2c(s1)C(C)(C)OC2(C)C
InChIInChI=1S/C11H18N2OS/c1-10(2)8-9(11(3,4)14-10)15-7(13-8)6-12-5/h12H,6H2,1-5H3
InChIKeyYYICYUIYEOPGMR-UHFFFAOYSA-N
XLogP2.36
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine?
The IUPAC name of N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine (CID 79916136) is N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine is CNCc1nc2c(s1)C(C)(C)OC2(C)C.
What is the InChIKey of N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine?
The InChIKey is YYICYUIYEOPGMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-10(2)8-9(11(3,4)14-10)15-7(13-8)6-12-5/h12H,6H2,1-5H3.
What are the key properties of N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine?
N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine has a molecular weight of 226.34 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4,4,6,6-tetramethylfuro[3,4-d][1,3]thiazol-2-yl)methanamine is sourced from PubChem (CID 79916136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).