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

C11H20N2OS — CID 102929390

IUPAC2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine
SMILESCCOC(C)(C)c1nc(C(C)CN)cs1
InChIInChI=1S/C11H20N2OS/c1-5-14-11(3,4)10-13-9(7-15-10)8(2)6-12/h7-8H,5-6,12H2,1-4H3
InChIKeyRWUOMHICDBDASB-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.48
Rot. Bonds5

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

2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine (PubChem CID 102929390) has the molecular formula C11H20N2OS and a molecular weight of 228.36 g/mol. Its IUPAC name is 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine.

Molecular Properties

Compound Name2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine
PubChem CID102929390
Molecular FormulaC11H20N2OS
Molecular Weight228.36 g/mol
Exact Mass228.13
IUPAC Name2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine
SMILESCCOC(C)(C)c1nc(C(C)CN)cs1
InChIInChI=1S/C11H20N2OS/c1-5-14-11(3,4)10-13-9(7-15-10)8(2)6-12/h7-8H,5-6,12H2,1-4H3
InChIKeyRWUOMHICDBDASB-UHFFFAOYSA-N
XLogP2.48
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 ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxypropan-2-yl)-4-propan-2-yl-1,3-thiazole
CID 116734587
1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 116727806
1-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-2-amine
CID 102929371
2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]-2-methylpropan-1-amine
CID 102929394
2-[2-(2-ethoxybutan-2-yl)-1,3-thiazol-4-yl]-3-methylbutan-1-amine
CID 102929481
4-(chloromethyl)-2-(2-ethoxypropan-2-yl)-1,3-thiazole
CID 116705109
2-(2-methoxy-1,3-thiazol-4-yl)propan-1-amine
CID 82598532
ethyl 3-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propanoate
CID 103485371
1-[2-(3-methoxypentan-3-yl)-1,3-thiazol-4-yl]ethanamine
CID 116774571
2-(4-propan-2-yl-1,3-thiazol-2-yl)propan-2-amine
CID 61337262
N-[[2-(3-ethoxypentan-3-yl)-1,3-thiazol-4-yl]methyl]butan-2-amine
CID 102929510
4-(2-bromophenyl)-2-(2-ethoxypropan-2-yl)-1,3-thiazole
CID 116734452

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine?
The IUPAC name of 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine (CID 102929390) is 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine.
What is the SMILES notation for 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine?
The canonical SMILES for 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine is CCOC(C)(C)c1nc(C(C)CN)cs1.
What is the InChIKey of 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine?
The InChIKey is RWUOMHICDBDASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2OS/c1-5-14-11(3,4)10-13-9(7-15-10)8(2)6-12/h7-8H,5-6,12H2,1-4H3.
What are the key properties of 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine?
2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine has a molecular weight of 228.36 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine is sourced from PubChem (CID 102929390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).