(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol

C10H14N4O2S — CID 105130490

IUPAC(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol
SMILESCCCn1ncc(OC)c1C(O)c1cnsn1
InChIInChI=1S/C10H14N4O2S/c1-3-4-14-9(8(16-2)6-11-14)10(15)7-5-12-17-13-7/h5-6,10,15H,3-4H2,1-2H3
InChIKeyWJSWTVLNKNLNOO-UHFFFAOYSA-N
MW254.31 g/mol
LogP1.23
Rot. Bonds5

About (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol

(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol (PubChem CID 105130490) has the molecular formula C10H14N4O2S and a molecular weight of 254.31 g/mol. Its IUPAC name is (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol.

Molecular Properties

Compound Name(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol
PubChem CID105130490
Molecular FormulaC10H14N4O2S
Molecular Weight254.31 g/mol
Exact Mass254.08
IUPAC Name(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol
SMILESCCCn1ncc(OC)c1C(O)c1cnsn1
InChIInChI=1S/C10H14N4O2S/c1-3-4-14-9(8(16-2)6-11-14)10(15)7-5-12-17-13-7/h5-6,10,15H,3-4H2,1-2H3
InChIKeyWJSWTVLNKNLNOO-UHFFFAOYSA-N
XLogP1.23
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-(4-methoxy-1-propylpyrazol-5-yl)-N-methyl-1-(1,2,5-thiadiazol-3-yl)methanamine
CID 105187073
[(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
CID 105339799
(4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol
CID 114638165
(4-methoxy-1-propylpyrazol-5-yl)-(3-methoxythiophen-2-yl)methanol
CID 115837711
(1,5-dimethylpyrazol-4-yl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114636784
(4-methoxy-1-propylpyrazol-5-yl)-(3-propylimidazol-4-yl)methanol
CID 114636682
1-(4-methoxy-1-propylpyrazol-5-yl)pentan-1-ol
CID 114635614
(4-methoxy-1-propylpyrazol-5-yl)-(4-propylthiadiazol-5-yl)methanol
CID 105130551
2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114643704
furan-3-yl-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114635264
2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114644693
4-[hydroxy-(4-methoxy-1-propylpyrazol-5-yl)methyl]benzonitrile
CID 114637571

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol?
The IUPAC name of (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol (CID 105130490) is (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol.
What is the SMILES notation for (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol?
The canonical SMILES for (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol is CCCn1ncc(OC)c1C(O)c1cnsn1.
What is the InChIKey of (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol?
The InChIKey is WJSWTVLNKNLNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2S/c1-3-4-14-9(8(16-2)6-11-14)10(15)7-5-12-17-13-7/h5-6,10,15H,3-4H2,1-2H3.
What are the key properties of (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol?
(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol has a molecular weight of 254.31 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol is sourced from PubChem (CID 105130490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).