(1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol

C14H17NO2S — CID 55189009

IUPAC(1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol
SMILESCC[C@H](O)c1ccc(OCc2csc(C)n2)cc1
InChIInChI=1S/C14H17NO2S/c1-3-14(16)11-4-6-13(7-5-11)17-8-12-9-18-10(2)15-12/h4-7,9,14,16H,3,8H2,1-2H3/t14-/m0/s1
InChIKeyCEWWESQTZKCSEQ-AWEZNQCLSA-N
MW263.36 g/mol
LogP3.47
Rot. Bonds5

About (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol

(1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol (PubChem CID 55189009) has the molecular formula C14H17NO2S and a molecular weight of 263.36 g/mol. Its IUPAC name is (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol.

Molecular Properties

Compound Name(1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol
PubChem CID55189009
Molecular FormulaC14H17NO2S
Molecular Weight263.36 g/mol
Exact Mass263.10
IUPAC Name(1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol
SMILESCC[C@H](O)c1ccc(OCc2csc(C)n2)cc1
InChIInChI=1S/C14H17NO2S/c1-3-14(16)11-4-6-13(7-5-11)17-8-12-9-18-10(2)15-12/h4-7,9,14,16H,3,8H2,1-2H3/t14-/m0/s1
InChIKeyCEWWESQTZKCSEQ-AWEZNQCLSA-N
XLogP3.47
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol with MolForge

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Related Compounds

2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propoxyphenyl)ethanol
CID 62799154
1-[4-(1,3-thiazol-4-ylmethoxy)phenyl]propan-1-ol
CID 43504474
2-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
CID 58112081
N-[1-(4-ethoxyphenyl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzamide
CID 55473945
2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethanol
CID 62799330
1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol
CID 111448152
1-[3-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
CID 43503813
(1R)-1-[4-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
CID 63364376
(1R)-1-[4-[(1-propan-2-ylpyrazol-3-yl)methoxy]phenyl]propan-1-ol
CID 64773103
N'-hydroxy-2-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanimidamide
CID 77103772
1-[4-(1-hydroxypropyl)phenoxy]butan-2-ol
CID 60887102
2-methyl-3-[[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]methylamino]propan-1-ol
CID 110905977

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol?
The IUPAC name of (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol (CID 55189009) is (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol.
What is the SMILES notation for (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol?
The canonical SMILES for (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol is CC[C@H](O)c1ccc(OCc2csc(C)n2)cc1.
What is the InChIKey of (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol?
The InChIKey is CEWWESQTZKCSEQ-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H17NO2S/c1-3-14(16)11-4-6-13(7-5-11)17-8-12-9-18-10(2)15-12/h4-7,9,14,16H,3,8H2,1-2H3/t14-/m0/s1.
What are the key properties of (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol?
(1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol has a molecular weight of 263.36 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol is sourced from PubChem (CID 55189009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).