1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine

C11H20N2OS — CID 102929371

IUPAC1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine
SMILESCCOC(C)(C)c1nc(CC(C)N)cs1
InChIInChI=1S/C11H20N2OS/c1-5-14-11(3,4)10-13-9(7-15-10)6-8(2)12/h7-8H,5-6,12H2,1-4H3
InChIKeyRMVMSIFKYVPVHL-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.30
Rot. Bonds5

About 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine

1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine (PubChem CID 102929371) has the molecular formula C11H20N2OS and a molecular weight of 228.36 g/mol. Its IUPAC name is 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine.

Molecular Properties

Compound Name1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine
PubChem CID102929371
Molecular FormulaC11H20N2OS
Molecular Weight228.36 g/mol
Exact Mass228.13
IUPAC Name1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine
SMILESCCOC(C)(C)c1nc(CC(C)N)cs1
InChIInChI=1S/C11H20N2OS/c1-5-14-11(3,4)10-13-9(7-15-10)6-8(2)12/h7-8H,5-6,12H2,1-4H3
InChIKeyRMVMSIFKYVPVHL-UHFFFAOYSA-N
XLogP2.30
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(chloromethyl)-2-(2-ethoxypropan-2-yl)-1,3-thiazole
CID 116705109
2-(2-ethoxypropan-2-yl)-4-propan-2-yl-1,3-thiazole
CID 116734587
2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine
CID 102929390
ethyl 3-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propanoate
CID 103485371
4-(2-tert-butyl-1,3-thiazol-4-yl)butan-2-amine
CID 116888399
1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 116727806
1-[2-(2-ethoxybutan-2-yl)-1,3-thiazol-4-yl]pentan-2-amine
CID 102929467
2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]-2-methylpropan-1-amine
CID 102929394
N-[[2-(3-ethoxypentan-3-yl)-1,3-thiazol-4-yl]methyl]butan-2-amine
CID 102929510
2-[2-(2-ethoxybutan-2-yl)-1,3-thiazol-4-yl]ethanamine
CID 116779537
N-[[2-(3-ethoxypentan-3-yl)-1,3-thiazol-4-yl]methyl]ethanamine
CID 116774720
N-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-4-methylpentan-2-amine
CID 115715580

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine?
The IUPAC name of 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine (CID 102929371) is 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine.
What is the SMILES notation for 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine?
The canonical SMILES for 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine is CCOC(C)(C)c1nc(CC(C)N)cs1.
What is the InChIKey of 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine?
The InChIKey is RMVMSIFKYVPVHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2OS/c1-5-14-11(3,4)10-13-9(7-15-10)6-8(2)12/h7-8H,5-6,12H2,1-4H3.
What are the key properties of 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine?
1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine has a molecular weight of 228.36 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine is sourced from PubChem (CID 102929371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).