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

C11H15N3O2S — CID 114638165

IUPAC(4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol
SMILESCCCn1ncc(OC)c1C(O)c1nccs1
InChIInChI=1S/C11H15N3O2S/c1-3-5-14-9(8(16-2)7-13-14)10(15)11-12-4-6-17-11/h4,6-7,10,15H,3,5H2,1-2H3
InChIKeyWTTQHAVPWVCCCU-UHFFFAOYSA-N
MW253.33 g/mol
LogP1.84
Rot. Bonds5

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

(4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol (PubChem CID 114638165) has the molecular formula C11H15N3O2S and a molecular weight of 253.33 g/mol. Its IUPAC name is (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol.

Molecular Properties

Compound Name(4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol
PubChem CID114638165
Molecular FormulaC11H15N3O2S
Molecular Weight253.33 g/mol
Exact Mass253.09
IUPAC Name(4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol
SMILESCCCn1ncc(OC)c1C(O)c1nccs1
InChIInChI=1S/C11H15N3O2S/c1-3-5-14-9(8(16-2)7-13-14)10(15)11-12-4-6-17-11/h4,6-7,10,15H,3,5H2,1-2H3
InChIKeyWTTQHAVPWVCCCU-UHFFFAOYSA-N
XLogP1.84
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(4-chloro-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol
CID 114638157
(4-methoxy-1-propylpyrazol-5-yl)-(3-methoxythiophen-2-yl)methanol
CID 115837711
(4-methoxy-1-propylpyrazol-5-yl)-(3-propylimidazol-4-yl)methanol
CID 114636682
(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol
CID 105130490
(2-ethoxyphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114634116
(1,5-dimethylpyrazol-4-yl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114636784
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
furan-3-yl-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114635264
(3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114644779
2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114644693
(1-ethyl-4-methoxypyrazol-5-yl)-(3-methoxythiophen-2-yl)methanol
CID 115837106

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol?
The IUPAC name of (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol (CID 114638165) is (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol.
What is the SMILES notation for (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol?
The canonical SMILES for (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol is CCCn1ncc(OC)c1C(O)c1nccs1.
What is the InChIKey of (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol?
The InChIKey is WTTQHAVPWVCCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2S/c1-3-5-14-9(8(16-2)7-13-14)10(15)11-12-4-6-17-11/h4,6-7,10,15H,3,5H2,1-2H3.
What are the key properties of (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol?
(4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol has a molecular weight of 253.33 g/mol, XLogP of 1.84, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol is sourced from PubChem (CID 114638165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).