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

C15H19NO2S — CID 78933888

IUPAC(1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
SMILESCCCc1nc(COc2cccc([C@H](C)O)c2)cs1
InChIInChI=1S/C15H19NO2S/c1-3-5-15-16-13(10-19-15)9-18-14-7-4-6-12(8-14)11(2)17/h4,6-8,10-11,17H,3,5,9H2,1-2H3/t11-/m0/s1
InChIKeyGGTWIJNTYDGDBZ-NSHDSACASA-N
MW277.39 g/mol
LogP3.73
Rot. Bonds6

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

(1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol (PubChem CID 78933888) has the molecular formula C15H19NO2S and a molecular weight of 277.39 g/mol. Its IUPAC name is (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
PubChem CID78933888
Molecular FormulaC15H19NO2S
Molecular Weight277.39 g/mol
Exact Mass277.11
IUPAC Name(1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
SMILESCCCc1nc(COc2cccc([C@H](C)O)c2)cs1
InChIInChI=1S/C15H19NO2S/c1-3-5-15-16-13(10-19-15)9-18-14-7-4-6-12(8-14)11(2)17/h4,6-8,10-11,17H,3,5,9H2,1-2H3/t11-/m0/s1
InChIKeyGGTWIJNTYDGDBZ-NSHDSACASA-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]ethanol
CID 61487424
4-[4-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]butan-2-ol
CID 61487425
1-[4-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-amine
CID 61487377
4-[(4-fluorophenoxy)methyl]-2-propyl-1,3-thiazole
CID 60773447
4-[(4-bromophenoxy)methyl]-2-propyl-1,3-thiazole
CID 60773438
[2-[2-(3-propan-2-ylphenoxy)ethyl]-1,3-thiazol-4-yl]methanamine
CID 82104681
2-methyl-4-[(2-propyl-1,3-thiazol-4-yl)methoxy]benzoic acid
CID 107671236
[2-[2-(3-propan-2-ylphenoxy)ethyl]-1,3-thiazol-4-yl]methanethiol
CID 82516432
1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
CID 61487340
(1S)-1-[4-[(2-ethyl-1,3-thiazol-4-yl)methoxy]-3-methoxyphenyl]ethanol
CID 78931623
N-[[2-[(3-propan-2-ylphenoxy)methyl]-1,3-thiazol-4-yl]methyl]propan-2-amine
CID 82193815
(1S)-1-(3-butoxyphenyl)ethanol
CID 78933868

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol?
The IUPAC name of (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol (CID 78933888) is (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol?
The canonical SMILES for (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol is CCCc1nc(COc2cccc([C@H](C)O)c2)cs1.
What is the InChIKey of (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol?
The InChIKey is GGTWIJNTYDGDBZ-NSHDSACASA-N. The full InChI is InChI=1S/C15H19NO2S/c1-3-5-15-16-13(10-19-15)9-18-14-7-4-6-12(8-14)11(2)17/h4,6-8,10-11,17H,3,5,9H2,1-2H3/t11-/m0/s1.
What are the key properties of (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol?
(1S)-1-[3-[(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 (1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol is sourced from PubChem (CID 78933888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).