1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol

C10H17NO3S — CID 102928798

IUPAC1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol
SMILESCOCCOCCc1nc(C(C)O)cs1
InChIInChI=1S/C10H17NO3S/c1-8(12)9-7-15-10(11-9)3-4-14-6-5-13-2/h7-8,12H,3-6H2,1-2H3
InChIKeyURSTXPQNBFXHOK-UHFFFAOYSA-N
MW231.32 g/mol
LogP1.40
Rot. Bonds7

About 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol

1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol (PubChem CID 102928798) has the molecular formula C10H17NO3S and a molecular weight of 231.32 g/mol. Its IUPAC name is 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol.

Molecular Properties

Compound Name1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol
PubChem CID102928798
Molecular FormulaC10H17NO3S
Molecular Weight231.32 g/mol
Exact Mass231.09
IUPAC Name1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol
SMILESCOCCOCCc1nc(C(C)O)cs1
InChIInChI=1S/C10H17NO3S/c1-8(12)9-7-15-10(11-9)3-4-14-6-5-13-2/h7-8,12H,3-6H2,1-2H3
InChIKeyURSTXPQNBFXHOK-UHFFFAOYSA-N
XLogP1.40
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.32
LogP ≤ 51.40
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-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]butan-2-amine
CID 102929672
1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]butan-1-amine
CID 102929666
4-(dimethoxymethyl)-2-(2-methoxyethyl)-1,3-thiazole
CID 66056933
3-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]-N-propan-2-ylpropan-1-amine
CID 102929665
N-ethyl-1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]propan-2-amine
CID 102929669
1-[2-[2-(2,2-difluoroethoxy)ethyl]-1,3-thiazol-4-yl]ethanamine
CID 103150135
1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]cyclopropane-1-carbonitrile
CID 166314569
3-[2-[2-(2,2-difluoroethoxy)ethyl]-1,3-thiazol-4-yl]butan-2-amine
CID 103151323
1-[2-[2-(2,2-difluoroethoxy)ethyl]-1,3-thiazol-4-yl]-2-methylbutan-1-amine
CID 103151365
2-[2-(2-ethoxyethyl)-1,3-thiazol-4-yl]-N-ethylpropan-1-amine
CID 106815876
methyl 2-(2-methoxyethyl)-1,3-thiazole-4-carboxylate
CID 115422665
2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(aminomethyl)-1,3-thiazole-4-carboxylate
CID 104562946

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol?
The IUPAC name of 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol (CID 102928798) is 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol.
What is the SMILES notation for 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol?
The canonical SMILES for 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol is COCCOCCc1nc(C(C)O)cs1.
What is the InChIKey of 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol?
The InChIKey is URSTXPQNBFXHOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3S/c1-8(12)9-7-15-10(11-9)3-4-14-6-5-13-2/h7-8,12H,3-6H2,1-2H3.
What are the key properties of 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol?
1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol has a molecular weight of 231.32 g/mol, XLogP of 1.40, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-methoxyethoxy)ethyl]-1,3-thiazol-4-yl]ethanol is sourced from PubChem (CID 102928798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).