1-phenylmethoxy-5-thiophen-2-ylpyrazole

C14H12N2OS — CID 11086368

IUPAC1-phenylmethoxy-5-thiophen-2-ylpyrazole
SMILESc1ccc(COn2nccc2-c2cccs2)cc1
InChIInChI=1S/C14H12N2OS/c1-2-5-12(6-3-1)11-17-16-13(8-9-15-16)14-7-4-10-18-14/h1-10H,11H2
InChIKeyJEHHIKVOGXNLCE-UHFFFAOYSA-N
MW256.33 g/mol
LogP3.24
Rot. Bonds4

About 1-phenylmethoxy-5-thiophen-2-ylpyrazole

1-phenylmethoxy-5-thiophen-2-ylpyrazole (PubChem CID 11086368) has the molecular formula C14H12N2OS and a molecular weight of 256.33 g/mol. Its IUPAC name is 1-phenylmethoxy-5-thiophen-2-ylpyrazole.

Molecular Properties

Compound Name1-phenylmethoxy-5-thiophen-2-ylpyrazole
PubChem CID11086368
Molecular FormulaC14H12N2OS
Molecular Weight256.33 g/mol
Exact Mass256.07
IUPAC Name1-phenylmethoxy-5-thiophen-2-ylpyrazole
SMILESc1ccc(COn2nccc2-c2cccs2)cc1
InChIInChI=1S/C14H12N2OS/c1-2-5-12(6-3-1)11-17-16-13(8-9-15-16)14-7-4-10-18-14/h1-10H,11H2
InChIKeyJEHHIKVOGXNLCE-UHFFFAOYSA-N
XLogP3.24
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-Phenylmethoxy-5-thiophen-2-yltriazole
CID 11747260
1-(2-Thiophen-2-ylethoxy)indazole
CID 123952033
1-Phenylmethoxy-4-thiophen-2-ylpyrazole
CID 10658740
N-[2-(1-phenylmethoxypyrazol-4-yl)phenyl]-1-thiophen-2-ylmethanimine
CID 10970412
(5-phenyl-1H-pyrazol-4-yl)-thiophen-2-ylmethanol
CID 80133640
(5-methylthiophen-3-yl)-(5-phenyl-1H-pyrazol-4-yl)methanol
CID 80133644
(5-phenyl-1H-pyrazol-4-yl)-thiophen-3-ylmethanol
CID 80133902
1-(5-phenyl-1H-pyrazol-4-yl)-2-thiophen-3-ylethanol
CID 80134088
(3-methylthiophen-2-yl)-(5-phenyl-1H-pyrazol-4-yl)methanol
CID 80134182
1-(5-phenyl-1H-pyrazol-4-yl)-2-thiophen-2-ylethanol
CID 80134465
N-phenylmethoxy-1-(5-thiophen-2-yl-1H-pyrazol-4-yl)methanamine
CID 82709056
(2-methylthiophen-3-yl)-(5-phenyl-1H-pyrazol-4-yl)methanol
CID 102829330

Frequently Asked Questions

What is the IUPAC name of 1-phenylmethoxy-5-thiophen-2-ylpyrazole?
The IUPAC name of 1-phenylmethoxy-5-thiophen-2-ylpyrazole (CID 11086368) is 1-phenylmethoxy-5-thiophen-2-ylpyrazole.
What is the SMILES notation for 1-phenylmethoxy-5-thiophen-2-ylpyrazole?
The canonical SMILES for 1-phenylmethoxy-5-thiophen-2-ylpyrazole is c1ccc(COn2nccc2-c2cccs2)cc1.
What is the InChIKey of 1-phenylmethoxy-5-thiophen-2-ylpyrazole?
The InChIKey is JEHHIKVOGXNLCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2OS/c1-2-5-12(6-3-1)11-17-16-13(8-9-15-16)14-7-4-10-18-14/h1-10H,11H2.
What are the key properties of 1-phenylmethoxy-5-thiophen-2-ylpyrazole?
1-phenylmethoxy-5-thiophen-2-ylpyrazole has a molecular weight of 256.33 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylmethoxy-5-thiophen-2-ylpyrazole is sourced from PubChem (CID 11086368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).