(1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol

C10H14N4OS — CID 103138655

IUPAC(1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol
SMILESCC(C)c1nnsc1C(O)c1ccn(C)n1
InChIInChI=1S/C10H14N4OS/c1-6(2)8-10(16-13-11-8)9(15)7-4-5-14(3)12-7/h4-6,9,15H,1-3H3
InChIKeyJUQSTZMBPOOEMT-UHFFFAOYSA-N
MW238.32 g/mol
LogP1.48
Rot. Bonds3

About (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol

(1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol (PubChem CID 103138655) has the molecular formula C10H14N4OS and a molecular weight of 238.32 g/mol. Its IUPAC name is (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol.

Molecular Properties

Compound Name(1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol
PubChem CID103138655
Molecular FormulaC10H14N4OS
Molecular Weight238.32 g/mol
Exact Mass238.09
IUPAC Name(1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol
SMILESCC(C)c1nnsc1C(O)c1ccn(C)n1
InChIInChI=1S/C10H14N4OS/c1-6(2)8-10(16-13-11-8)9(15)7-4-5-14(3)12-7/h4-6,9,15H,1-3H3
InChIKeyJUQSTZMBPOOEMT-UHFFFAOYSA-N
XLogP1.48
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.32
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol?
The IUPAC name of (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol (CID 103138655) is (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol.
What is the SMILES notation for (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol?
The canonical SMILES for (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol is CC(C)c1nnsc1C(O)c1ccn(C)n1.
What is the InChIKey of (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol?
The InChIKey is JUQSTZMBPOOEMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4OS/c1-6(2)8-10(16-13-11-8)9(15)7-4-5-14(3)12-7/h4-6,9,15H,1-3H3.
What are the key properties of (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol?
(1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol has a molecular weight of 238.32 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpyrazol-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol is sourced from PubChem (CID 103138655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).