1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol

C15H19NO2S — CID 61487424

IUPAC1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
SMILESCCCc1nc(COc2ccccc2C(C)O)cs1
InChIInChI=1S/C15H19NO2S/c1-3-6-15-16-12(10-19-15)9-18-14-8-5-4-7-13(14)11(2)17/h4-5,7-8,10-11,17H,3,6,9H2,1-2H3
InChIKeyLPJSPNMKZNIKNY-UHFFFAOYSA-N
MW277.39 g/mol
LogP3.73
Rot. Bonds6

About 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol

1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol (PubChem CID 61487424) has the molecular formula C15H19NO2S and a molecular weight of 277.39 g/mol. Its IUPAC name is 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
PubChem CID61487424
Molecular FormulaC15H19NO2S
Molecular Weight277.39 g/mol
Exact Mass277.11
IUPAC Name1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
SMILESCCCc1nc(COc2ccccc2C(C)O)cs1
InChIInChI=1S/C15H19NO2S/c1-3-6-15-16-12(10-19-15)9-18-14-8-5-4-7-13(14)11(2)17/h4-5,7-8,10-11,17H,3,6,9H2,1-2H3
InChIKeyLPJSPNMKZNIKNY-UHFFFAOYSA-N
XLogP3.73
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
CID 61487340
2-[(2-propyl-1,3-thiazol-4-yl)methoxy]benzoic acid
CID 43310246
(1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
CID 78933888
(1S)-1-[4-fluoro-2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
CID 78935756
N-[[4-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazol-2-yl]methyl]propan-1-amine
CID 62459083
(1R)-1-[5-chloro-2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
CID 63366752
1-[2-[(2-ethyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-amine
CID 61484148
(1S)-1-[2-(1,3-thiazol-4-ylmethoxy)phenyl]ethanol
CID 78931487
(1R)-1-[4-methyl-2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
CID 63649933
(1S)-1-[2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol
CID 63364149
[3-ethoxy-2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]methanol
CID 61487304
(1S)-1-[2-[(2-ethyl-1,3-thiazol-4-yl)methoxy]-4-methoxyphenyl]ethanol
CID 82001873

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol?
The IUPAC name of 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol (CID 61487424) is 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol.
What is the SMILES notation for 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol?
The canonical SMILES for 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol is CCCc1nc(COc2ccccc2C(C)O)cs1.
What is the InChIKey of 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol?
The InChIKey is LPJSPNMKZNIKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2S/c1-3-6-15-16-12(10-19-15)9-18-14-8-5-4-7-13(14)11(2)17/h4-5,7-8,10-11,17H,3,6,9H2,1-2H3.
What are the key properties of 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol?
1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol has a molecular weight of 277.39 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol is sourced from PubChem (CID 61487424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).