[2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol

C11H20N2OS — CID 79393490

IUPAC[2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
SMILESCC(C)c1nc(N(C)C(C)C)sc1CO
InChIInChI=1S/C11H20N2OS/c1-7(2)10-9(6-14)15-11(12-10)13(5)8(3)4/h7-8,14H,6H2,1-5H3
InChIKeyLNVCMSDOQMYVGI-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.60
Rot. Bonds4

About [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol

[2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol (PubChem CID 79393490) has the molecular formula C11H20N2OS and a molecular weight of 228.36 g/mol. Its IUPAC name is [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
PubChem CID79393490
Molecular FormulaC11H20N2OS
Molecular Weight228.36 g/mol
Exact Mass228.13
IUPAC Name[2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
SMILESCC(C)c1nc(N(C)C(C)C)sc1CO
InChIInChI=1S/C11H20N2OS/c1-7(2)10-9(6-14)15-11(12-10)13(5)8(3)4/h7-8,14H,6H2,1-5H3
InChIKeyLNVCMSDOQMYVGI-UHFFFAOYSA-N
XLogP2.60
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol (CID 79393490) is [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol is CC(C)c1nc(N(C)C(C)C)sc1CO.
What is the InChIKey of [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol?
The InChIKey is LNVCMSDOQMYVGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2OS/c1-7(2)10-9(6-14)15-11(12-10)13(5)8(3)4/h7-8,14H,6H2,1-5H3.
What are the key properties of [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol?
[2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol has a molecular weight of 228.36 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methyl(propan-2-yl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 79393490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).