[2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol

C14H17NO3S — CID 105125520

IUPAC[2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol
SMILESCOCCOc1ccccc1C(O)c1scnc1C
InChIInChI=1S/C14H17NO3S/c1-10-14(19-9-15-10)13(16)11-5-3-4-6-12(11)18-8-7-17-2/h3-6,9,13,16H,7-8H2,1-2H3
InChIKeyQSXWRIIXLZWCDM-UHFFFAOYSA-N
MW279.36 g/mol
LogP2.56
Rot. Bonds6

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

[2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol (PubChem CID 105125520) has the molecular formula C14H17NO3S and a molecular weight of 279.36 g/mol. Its IUPAC name is [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol.

Molecular Properties

Compound Name[2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol
PubChem CID105125520
Molecular FormulaC14H17NO3S
Molecular Weight279.36 g/mol
Exact Mass279.09
IUPAC Name[2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol
SMILESCOCCOc1ccccc1C(O)c1scnc1C
InChIInChI=1S/C14H17NO3S/c1-10-14(19-9-15-10)13(16)11-5-3-4-6-12(11)18-8-7-17-2/h3-6,9,13,16H,7-8H2,1-2H3
InChIKeyQSXWRIIXLZWCDM-UHFFFAOYSA-N
XLogP2.56
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(3-bromothiophen-2-yl)-[2-(2-methoxyethoxy)phenyl]methanol
CID 104658901
[2-(2-methoxyethoxy)phenyl]-(3-methyl-2-pyridinyl)methanol
CID 104659512
(4-fluorophenyl)-[2-(2-methoxyethoxy)phenyl]methanol
CID 104658593
[2-(2-methoxyethoxy)phenyl]-(2-methylfuran-3-yl)methanol
CID 104789530
2-amino-1-[2-(2-methoxyethoxy)phenyl]ethanol
CID 102533880
3-[2-(2-methoxyethoxy)phenyl]butan-2-ol
CID 104662429
(3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol
CID 115833017
[2-(2-methoxyethoxy)phenyl]-(1-methylpyrazol-3-yl)methanol
CID 104659584
2,2-dimethoxy-1-[2-(2-methoxyethoxy)phenyl]ethanol
CID 104658798
(2-propoxyphenyl)-(1,3-thiazol-2-yl)methanol
CID 104658962
3-amino-1-[2-(2-methoxyethoxy)phenyl]propan-1-ol
CID 104658969
1-[2-(2-methoxyethoxy)phenyl]-2-phenylethanol
CID 104658697

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol?
The IUPAC name of [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol (CID 105125520) is [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol.
What is the SMILES notation for [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol?
The canonical SMILES for [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol is COCCOc1ccccc1C(O)c1scnc1C.
What is the InChIKey of [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol?
The InChIKey is QSXWRIIXLZWCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO3S/c1-10-14(19-9-15-10)13(16)11-5-3-4-6-12(11)18-8-7-17-2/h3-6,9,13,16H,7-8H2,1-2H3.
What are the key properties of [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol?
[2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol has a molecular weight of 279.36 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol is sourced from PubChem (CID 105125520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).