2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine

C21H17N3O — CID 174767188

IUPAC2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine
SMILESc1ccc(COc2cnn(-c3ccccc3)c2-c2ccccn2)cc1
InChIInChI=1S/C21H17N3O/c1-3-9-17(10-4-1)16-25-20-15-23-24(18-11-5-2-6-12-18)21(20)19-13-7-8-14-22-19/h1-15H,16H2
InChIKeyDFDPOPVKIMHLDO-UHFFFAOYSA-N
MW327.39 g/mol
LogP4.51
Rot. Bonds5

About 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine

2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine (PubChem CID 174767188) has the molecular formula C21H17N3O and a molecular weight of 327.39 g/mol. Its IUPAC name is 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine.

Molecular Properties

Compound Name2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine
PubChem CID174767188
Molecular FormulaC21H17N3O
Molecular Weight327.39 g/mol
Exact Mass327.14
IUPAC Name2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine
SMILESc1ccc(COc2cnn(-c3ccccc3)c2-c2ccccn2)cc1
InChIInChI=1S/C21H17N3O/c1-3-9-17(10-4-1)16-25-20-15-23-24(18-11-5-2-6-12-18)21(20)19-13-7-8-14-22-19/h1-15H,16H2
InChIKeyDFDPOPVKIMHLDO-UHFFFAOYSA-N
XLogP4.51
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-chloro-4-phenylmethoxypyrazol-1-yl)pyridine
CID 117232501
3-phenylmethoxy-5-pyridin-2-ylpyridin-2-amine
CID 21110977
2-(2,6-difluoro-3-phenylmethoxyphenyl)pyridine
CID 174635964
2-[2-(1-phenyl-3-phenylmethoxypyrazol-5-yl)ethenyl]pyridine
CID 69216426
1-phenyl-5-phenylmethoxytetrazole
CID 5082830
2-(2-phenylmethoxyphenoxy)pyridine
CID 19835584
6-chloro-1-phenyl-3-phenylmethoxypyrazolo[4,3-c]pyridine
CID 164548917
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
6-methyl-3-phenylmethoxypyrazolo[1,5-a]pyridine
CID 164559312
2-(3-bromo-2-phenylmethoxyphenyl)pyridine
CID 151807224
4-phenylmethoxyquinoline
CID 11299312

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine?
The IUPAC name of 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine (CID 174767188) is 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine.
What is the SMILES notation for 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine?
The canonical SMILES for 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine is c1ccc(COc2cnn(-c3ccccc3)c2-c2ccccn2)cc1.
What is the InChIKey of 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine?
The InChIKey is DFDPOPVKIMHLDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O/c1-3-9-17(10-4-1)16-25-20-15-23-24(18-11-5-2-6-12-18)21(20)19-13-7-8-14-22-19/h1-15H,16H2.
What are the key properties of 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine?
2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine has a molecular weight of 327.39 g/mol, XLogP of 4.51, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenyl-4-phenylmethoxypyrazol-5-yl)pyridine is sourced from PubChem (CID 174767188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).