1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol

C12H14N2OS — CID 114878683

IUPAC1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol
SMILESCc1ccncc1-c1nc(C)c(C(C)O)s1
InChIInChI=1S/C12H14N2OS/c1-7-4-5-13-6-10(7)12-14-8(2)11(16-12)9(3)15/h4-6,9,15H,1-3H3
InChIKeyWUTAGYGMSNFXFZ-UHFFFAOYSA-N
MW234.32 g/mol
LogP2.88
Rot. Bonds2

About 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol

1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol (PubChem CID 114878683) has the molecular formula C12H14N2OS and a molecular weight of 234.32 g/mol. Its IUPAC name is 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol.

Molecular Properties

Compound Name1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol
PubChem CID114878683
Molecular FormulaC12H14N2OS
Molecular Weight234.32 g/mol
Exact Mass234.08
IUPAC Name1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol
SMILESCc1ccncc1-c1nc(C)c(C(C)O)s1
InChIInChI=1S/C12H14N2OS/c1-7-4-5-13-6-10(7)12-14-8(2)11(16-12)9(3)15/h4-6,9,15H,1-3H3
InChIKeyWUTAGYGMSNFXFZ-UHFFFAOYSA-N
XLogP2.88
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethanol
CID 54593693
1-[2-(2-fluoro-4-methylphenyl)-4-methyl-1,3-thiazol-5-yl]ethanol
CID 62308724
(1R)-1-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]ethanol
CID 6923600
(1S)-1-[2-(4-bromophenyl)-4-methyl-1,3-thiazol-5-yl]ethanol
CID 94001078
1-[2-(3,4-dichlorophenyl)-4-methyl-1,3-thiazol-5-yl]ethanol
CID 21051230
(1R)-1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanol
CID 58697769
1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanol
CID 22647631
N-[[4-ethyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 114878725
methyl 4-chloro-2-(4-methyl-3-pyridinyl)-1,3-thiazole-5-carboxylate
CID 79079553
2-[4,6-dimethyl-2-(4-methyl-3-pyridinyl)pyrimidin-5-yl]propanoic acid
CID 114878657
N-methyl-1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethanamine
CID 61287607
2-amino-1-[2-(5-bromo-2-methylphenyl)-4-methyl-1,3-thiazol-5-yl]ethanol
CID 116886738

Frequently Asked Questions

What is the IUPAC name of 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol?
The IUPAC name of 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol (CID 114878683) is 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol.
What is the SMILES notation for 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol?
The canonical SMILES for 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol is Cc1ccncc1-c1nc(C)c(C(C)O)s1.
What is the InChIKey of 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol?
The InChIKey is WUTAGYGMSNFXFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS/c1-7-4-5-13-6-10(7)12-14-8(2)11(16-12)9(3)15/h4-6,9,15H,1-3H3.
What are the key properties of 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol?
1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol has a molecular weight of 234.32 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-methyl-2-(4-methyl-3-pyridinyl)-1,3-thiazol-5-yl]ethanol is sourced from PubChem (CID 114878683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).