2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine

C10H18N2OS — CID 19104032

IUPAC2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine
SMILESCc1csc(C(N)COC(C)(C)C)n1
InChIInChI=1S/C10H18N2OS/c1-7-6-14-9(12-7)8(11)5-13-10(2,3)4/h6,8H,5,11H2,1-4H3
InChIKeyJVNPIKMIOFTICF-UHFFFAOYSA-N
MW214.33 g/mol
LogP2.27
Rot. Bonds3

About 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine

2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine (PubChem CID 19104032) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine
PubChem CID19104032
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine
SMILESCc1csc(C(N)COC(C)(C)C)n1
InChIInChI=1S/C10H18N2OS/c1-7-6-14-9(12-7)8(11)5-13-10(2,3)4/h6,8H,5,11H2,1-4H3
InChIKeyJVNPIKMIOFTICF-UHFFFAOYSA-N
XLogP2.27
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine (CID 19104032) is 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine is Cc1csc(C(N)COC(C)(C)C)n1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The InChIKey is JVNPIKMIOFTICF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-7-6-14-9(12-7)8(11)5-13-10(2,3)4/h6,8H,5,11H2,1-4H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine?
2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine has a molecular weight of 214.33 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 19104032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).