5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine

C16H15N3O — CID 130360604

IUPAC5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine
SMILESCc1cccc(COc2ccc(-c3ccn[nH]3)nc2)c1
InChIInChI=1S/C16H15N3O/c1-12-3-2-4-13(9-12)11-20-14-5-6-15(17-10-14)16-7-8-18-19-16/h2-10H,11H2,1H3,(H,18,19)
InChIKeyRAFLMGVHLDXJMU-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.36
Rot. Bonds4

About 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine

5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine (PubChem CID 130360604) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine.

Molecular Properties

Compound Name5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine
PubChem CID130360604
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine
SMILESCc1cccc(COc2ccc(-c3ccn[nH]3)nc2)c1
InChIInChI=1S/C16H15N3O/c1-12-3-2-4-13(9-12)11-20-14-5-6-15(17-10-14)16-7-8-18-19-16/h2-10H,11H2,1H3,(H,18,19)
InChIKeyRAFLMGVHLDXJMU-UHFFFAOYSA-N
XLogP3.36
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl (E)-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]prop-2-enoate
CID 142527004
5-[(4-tert-butylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine
CID 155790764
4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid
CID 147289846
ethyl 3-hydroxy-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]cyclobutane-1-carboxylate
CID 146658371
N-(2-methoxypropyl)-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propanamide
CID 152802846
2-methoxy-4-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]benzoic acid
CID 142526497
4-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]benzoic acid
CID 142526977
5-[(3-methylphenyl)methoxy]pyridine-2-carbaldehyde
CID 79794315
2-[[[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]benzoyl]amino]methyl]benzoic acid
CID 148717921
[1-hydroxy-1-[4-[(3-methylphenyl)methoxy]phenyl]propan-2-yl]azanium chloride
CID 110184490
2-(4-methyl-1H-pyrazol-5-yl)-5-[(3-methylsulfonylphenyl)methoxy]pyridine
CID 130360176
1-methyl-3-[[4-[[4-[(3-methylphenyl)methoxy]phenyl]disulfanyl]phenoxy]methyl]benzene
CID 146262404

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine?
The IUPAC name of 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine (CID 130360604) is 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine.
What is the SMILES notation for 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine?
The canonical SMILES for 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine is Cc1cccc(COc2ccc(-c3ccn[nH]3)nc2)c1.
What is the InChIKey of 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine?
The InChIKey is RAFLMGVHLDXJMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-12-3-2-4-13(9-12)11-20-14-5-6-15(17-10-14)16-7-8-18-19-16/h2-10H,11H2,1H3,(H,18,19).
What are the key properties of 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine?
5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine has a molecular weight of 265.32 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine is sourced from PubChem (CID 130360604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).