(5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol

C11H14N2OS2 — CID 105109345

IUPAC(5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol
SMILESCCCc1nnsc1C(O)c1ccc(C)s1
InChIInChI=1S/C11H14N2OS2/c1-3-4-8-11(16-13-12-8)10(14)9-6-5-7(2)15-9/h5-6,10,14H,3-4H2,1-2H3
InChIKeyYLPONZUCOAPLPD-UHFFFAOYSA-N
MW254.38 g/mol
LogP2.94
Rot. Bonds4

About (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol

(5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol (PubChem CID 105109345) has the molecular formula C11H14N2OS2 and a molecular weight of 254.38 g/mol. Its IUPAC name is (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol.

Molecular Properties

Compound Name(5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol
PubChem CID105109345
Molecular FormulaC11H14N2OS2
Molecular Weight254.38 g/mol
Exact Mass254.05
IUPAC Name(5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol
SMILESCCCc1nnsc1C(O)c1ccc(C)s1
InChIInChI=1S/C11H14N2OS2/c1-3-4-8-11(16-13-12-8)10(14)9-6-5-7(2)15-9/h5-6,10,14H,3-4H2,1-2H3
InChIKeyYLPONZUCOAPLPD-UHFFFAOYSA-N
XLogP2.94
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-Methylthiophen-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol
CID 102842379
(4-Ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 102842425
(2-Methylthiophen-3-yl)-(4-propylthiadiazol-5-yl)methanol
CID 102842516
(4-Methylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 102842557
(4-Methylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079900
(4-Propan-2-ylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079956
(4-Ethylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079958
(4-Tert-butylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079978
(4-Propylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079979
2-(1-Benzothiophen-3-yl)-1-(4-ethylthiadiazol-5-yl)ethanol
CID 105083304
1-(4-Methylthiadiazol-5-yl)-2-thiophen-2-ylethanol
CID 105087134
1-(Thiadiazol-4-yl)-2-thiophen-2-ylethanol
CID 105087160

Frequently Asked Questions

What is the IUPAC name of (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol?
The IUPAC name of (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol (CID 105109345) is (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol.
What is the SMILES notation for (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol?
The canonical SMILES for (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol is CCCc1nnsc1C(O)c1ccc(C)s1.
What is the InChIKey of (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol?
The InChIKey is YLPONZUCOAPLPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2OS2/c1-3-4-8-11(16-13-12-8)10(14)9-6-5-7(2)15-9/h5-6,10,14H,3-4H2,1-2H3.
What are the key properties of (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol?
(5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol has a molecular weight of 254.38 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylthiophen-2-yl)-(4-propylthiadiazol-5-yl)methanol is sourced from PubChem (CID 105109345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).