2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine

C23H19N3O — CID 69216426

IUPAC2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine
SMILESC(=Cc1cc(OCc2ccccc2)nn1-c1ccccc1)c1ccccn1
InChIInChI=1S/C23H19N3O/c1-3-9-19(10-4-1)18-27-23-17-22(15-14-20-11-7-8-16-24-20)26(25-23)21-12-5-2-6-13-21/h1-17H,18H2
InChIKeyBJNVUYABOIRUER-UHFFFAOYSA-N
MW353.43 g/mol
LogP5.02
Rot. Bonds6

About 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine

2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine (PubChem CID 69216426) has the molecular formula C23H19N3O and a molecular weight of 353.43 g/mol. Its IUPAC name is 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine.

Molecular Properties

Compound Name2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine
PubChem CID69216426
Molecular FormulaC23H19N3O
Molecular Weight353.43 g/mol
Exact Mass353.15
IUPAC Name2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine
SMILESC(=Cc1cc(OCc2ccccc2)nn1-c1ccccc1)c1ccccn1
InChIInChI=1S/C23H19N3O/c1-3-9-19(10-4-1)18-27-23-17-22(15-14-20-11-7-8-16-24-20)26(25-23)21-12-5-2-6-13-21/h1-17H,18H2
InChIKeyBJNVUYABOIRUER-UHFFFAOYSA-N
XLogP5.02
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.43
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-phenyl-3,5-bis[(E)-2-phenylethenyl]pyrazole
CID 11302502
3-[2-[3-[2-(3-hydroxyphenyl)ethenyl]-1-phenylpyrazol-5-yl]ethenyl]phenol
CID 71416893
2-(2-pyridin-2-ylethenyl)pyridine
CID 161029843
2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine
CID 174767188
6-chloro-1-phenyl-3-phenylmethoxypyrazolo[4,3-c]pyridine
CID 164548917
ethyl (E)-3-(1-ethyl-3-phenylmethoxypyrazol-5-yl)prop-2-enoate
CID 86618830
3-phenyl-5-phenylmethoxyimidazo[4,5-b]pyridine
CID 67312864
1-phenyl-5-phenylmethoxytetrazole
CID 5082830
3,6-bis(phenylmethoxy)pyridazine
CID 68982842
2-[2-[3,5-bis(2-pyridin-2-ylethenyl)phenyl]ethenyl]pyridine
CID 5076981
2-[(E)-4-phenylbut-1-enyl]pyridine
CID 68904767
2-(4-phenylbut-1-enyl)pyridine
CID 68904769

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine?
The IUPAC name of 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine (CID 69216426) is 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine.
What is the SMILES notation for 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine?
The canonical SMILES for 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine is C(=Cc1cc(OCc2ccccc2)nn1-c1ccccc1)c1ccccn1.
What is the InChIKey of 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine?
The InChIKey is BJNVUYABOIRUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O/c1-3-9-19(10-4-1)18-27-23-17-22(15-14-20-11-7-8-16-24-20)26(25-23)21-12-5-2-6-13-21/h1-17H,18H2.
What are the key properties of 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine?
2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine has a molecular weight of 353.43 g/mol, XLogP of 5.02, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine is sourced from PubChem (CID 69216426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).