2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol

C10H10BrN3OS — CID 105126130

IUPAC2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol
SMILESCc1nnsc1C(O)Cc1ccc(Br)cn1
InChIInChI=1S/C10H10BrN3OS/c1-6-10(16-14-13-6)9(15)4-8-3-2-7(11)5-12-8/h2-3,5,9,15H,4H2,1H3
InChIKeyUTXWSAKBXXJYOQ-UHFFFAOYSA-N
MW300.18 g/mol
LogP2.28
Rot. Bonds3

About 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol

2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol (PubChem CID 105126130) has the molecular formula C10H10BrN3OS and a molecular weight of 300.18 g/mol. Its IUPAC name is 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol
PubChem CID105126130
Molecular FormulaC10H10BrN3OS
Molecular Weight300.18 g/mol
Exact Mass298.97
IUPAC Name2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol
SMILESCc1nnsc1C(O)Cc1ccc(Br)cn1
InChIInChI=1S/C10H10BrN3OS/c1-6-10(16-14-13-6)9(15)4-8-3-2-7(11)5-12-8/h2-3,5,9,15H,4H2,1H3
InChIKeyUTXWSAKBXXJYOQ-UHFFFAOYSA-N
XLogP2.28
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.18
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5-bromo-2-pyridinyl)-1-(2,6-dimethyl-4-pyridinyl)ethanol
CID 107502739
2-(5-bromo-2-pyridinyl)-1-(4-propan-2-ylthiadiazol-5-yl)ethanamine
CID 105180886
2-(5-bromo-2-pyridinyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105126285
2-(5-bromo-2-pyridinyl)-1-(3,5-dibromophenyl)ethanol
CID 107978662
2-(5-bromo-2-pyridinyl)-1-(3,5-dimethyl-2-pyridinyl)ethanol
CID 104800583
2-(5-bromo-2-pyridinyl)-1-(3-methyl-4-pyridinyl)ethanol
CID 104800540
2-(5-bromo-2-pyridinyl)-1-(1,3-thiazol-5-yl)ethanol
CID 104800447
1-(5-bromo-2-pyridinyl)-3,3-dimethylbutan-2-ol
CID 63200943
2-(5-bromo-2-pyridinyl)-1-(furan-2-yl)ethanol
CID 104800026
2-(5-bromo-2-pyridinyl)-1-(2-methylpyrazol-3-yl)ethanol
CID 114554148
N-[2-(5-bromo-2-pyridinyl)-1-(4-propylthiadiazol-5-yl)ethyl]propan-1-amine
CID 105180987
1-(5-bromo-2-pyridinyl)-3-methylpentan-2-ol
CID 104800109

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol?
The IUPAC name of 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol (CID 105126130) is 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol.
What is the SMILES notation for 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol?
The canonical SMILES for 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol is Cc1nnsc1C(O)Cc1ccc(Br)cn1.
What is the InChIKey of 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol?
The InChIKey is UTXWSAKBXXJYOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3OS/c1-6-10(16-14-13-6)9(15)4-8-3-2-7(11)5-12-8/h2-3,5,9,15H,4H2,1H3.
What are the key properties of 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol?
2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol has a molecular weight of 300.18 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-pyridinyl)-1-(4-methylthiadiazol-5-yl)ethanol is sourced from PubChem (CID 105126130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).