(1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol

C11H16N4OS — CID 65207463

IUPAC(1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol
SMILESCCCc1nnsc1C(O)c1nccn1CC
InChIInChI=1S/C11H16N4OS/c1-3-5-8-10(17-14-13-8)9(16)11-12-6-7-15(11)4-2/h6-7,9,16H,3-5H2,1-2H3
InChIKeyQWAFPRGPLBNBJW-UHFFFAOYSA-N
MW252.34 g/mol
LogP1.79
Rot. Bonds5

About (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol

(1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol (PubChem CID 65207463) has the molecular formula C11H16N4OS and a molecular weight of 252.34 g/mol. Its IUPAC name is (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol.

Molecular Properties

Compound Name(1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol
PubChem CID65207463
Molecular FormulaC11H16N4OS
Molecular Weight252.34 g/mol
Exact Mass252.10
IUPAC Name(1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol
SMILESCCCc1nnsc1C(O)c1nccn1CC
InChIInChI=1S/C11H16N4OS/c1-3-5-8-10(17-14-13-8)9(16)11-12-6-7-15(11)4-2/h6-7,9,16H,3-5H2,1-2H3
InChIKeyQWAFPRGPLBNBJW-UHFFFAOYSA-N
XLogP1.79
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[(1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methyl]hydrazine
CID 105308426
[2-(1-ethylimidazol-2-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
CID 105321812
[(1-ethylimidazol-2-yl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105308543
(1-ethylpyrazol-4-yl)-(4-propylthiadiazol-5-yl)methanol
CID 105081847
(1-ethylimidazol-2-yl)-pyridazin-4-ylmethanol
CID 104672120
furan-2-yl-(4-propylthiadiazol-5-yl)methanol
CID 105097375
1-(1-ethylimidazol-2-yl)-3,3-dimethylbutane-1,2-diol
CID 103457324
cyclohexen-1-yl-(4-propylthiadiazol-5-yl)methanol
CID 106657927
2-ethyl-1-(4-propylthiadiazol-5-yl)butan-1-ol
CID 105114699
(3,5-dimethoxypyrazin-2-yl)-(4-propylthiadiazol-5-yl)methanol
CID 105123476
3-(1-ethylimidazol-2-yl)-2,3-dihydroxypropanamide
CID 171869595
1-cyclopropyl-2-(1-ethylimidazol-2-yl)ethane-1,2-diol
CID 103456993

Frequently Asked Questions

What is the IUPAC name of (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol?
The IUPAC name of (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol (CID 65207463) is (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol.
What is the SMILES notation for (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol?
The canonical SMILES for (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol is CCCc1nnsc1C(O)c1nccn1CC.
What is the InChIKey of (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol?
The InChIKey is QWAFPRGPLBNBJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4OS/c1-3-5-8-10(17-14-13-8)9(16)11-12-6-7-15(11)4-2/h6-7,9,16H,3-5H2,1-2H3.
What are the key properties of (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol?
(1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol has a molecular weight of 252.34 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methanol is sourced from PubChem (CID 65207463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).