1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine

C10H18N2OS — CID 64573220

IUPAC1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine
SMILESCCc1csc(OCC(C)(N)CC)n1
InChIInChI=1S/C10H18N2OS/c1-4-8-6-14-9(12-8)13-7-10(3,11)5-2/h6H,4-5,7,11H2,1-3H3
InChIKeyUVLVWSJFMHFLCS-UHFFFAOYSA-N
MW214.33 g/mol
LogP2.21
Rot. Bonds5

About 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine

1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine (PubChem CID 64573220) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine.

Molecular Properties

Compound Name1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine
PubChem CID64573220
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine
SMILESCCc1csc(OCC(C)(N)CC)n1
InChIInChI=1S/C10H18N2OS/c1-4-8-6-14-9(12-8)13-7-10(3,11)5-2/h6H,4-5,7,11H2,1-3H3
InChIKeyUVLVWSJFMHFLCS-UHFFFAOYSA-N
XLogP2.21
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine?
The IUPAC name of 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine (CID 64573220) is 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine.
What is the SMILES notation for 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine?
The canonical SMILES for 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine is CCc1csc(OCC(C)(N)CC)n1.
What is the InChIKey of 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine?
The InChIKey is UVLVWSJFMHFLCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-4-8-6-14-9(12-8)13-7-10(3,11)5-2/h6H,4-5,7,11H2,1-3H3.
What are the key properties of 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine?
1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine has a molecular weight of 214.33 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-ethyl-1,3-thiazol-2-yl)oxy]-2-methylbutan-2-amine is sourced from PubChem (CID 64573220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).