4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine

C18H16N2O — CID 175581548

IUPAC4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine
SMILESCc1c(OCc2ccccc2)cncc1-c1cccnc1
InChIInChI=1S/C18H16N2O/c1-14-17(16-8-5-9-19-10-16)11-20-12-18(14)21-13-15-6-3-2-4-7-15/h2-12H,13H2,1H3
InChIKeyKKTMQADISKOJFX-UHFFFAOYSA-N
MW276.34 g/mol
LogP4.03
Rot. Bonds4

About 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine

4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine (PubChem CID 175581548) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine.

Molecular Properties

Compound Name4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine
PubChem CID175581548
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC Name4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine
SMILESCc1c(OCc2ccccc2)cncc1-c1cccnc1
InChIInChI=1S/C18H16N2O/c1-14-17(16-8-5-9-19-10-16)11-20-12-18(14)21-13-15-6-3-2-4-7-15/h2-12H,13H2,1H3
InChIKeyKKTMQADISKOJFX-UHFFFAOYSA-N
XLogP4.03
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dimethyl-5-phenylmethoxypyridine
CID 70023630
4-methyl-3-phenylmethoxy-5-pyridin-3-yl-2-(trifluoromethyl)pyridine
CID 175581577
4-methyl-5-pyridin-3-ylpyridin-3-ol
CID 175581528
4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine
CID 178203209
2-phenylmethoxy-4-pyridin-3-ylbenzoic acid
CID 66989978
3-[[2-(pyridin-3-ylmethoxy)phenoxy]methyl]pyridine
CID 102197893
3-(2-methyl-3-phenylphenyl)pyridine
CID 91046767
2-phenylmethoxy-3-pyridin-3-ylbenzaldehyde
CID 22444385
4-methyl-3-propan-2-yl-5-pyridin-3-ylpyridine
CID 89458114
[2-(pyridin-3-ylmethoxy)phenyl]boronic acid
CID 43145276
3-phenylmethoxy-4-propylpyridine
CID 154694939
lithium;ethane;methane;oxopalladium;propane;propanoic acid;tris(3-[2-(2,3,4-trimethyl-6-phenylmethoxyphenyl)thiophen-3-yl]pyridine);hydroxide
CID 159837916

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine?
The IUPAC name of 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine (CID 175581548) is 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine.
What is the SMILES notation for 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine?
The canonical SMILES for 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine is Cc1c(OCc2ccccc2)cncc1-c1cccnc1.
What is the InChIKey of 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine?
The InChIKey is KKTMQADISKOJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c1-14-17(16-8-5-9-19-10-16)11-20-12-18(14)21-13-15-6-3-2-4-7-15/h2-12H,13H2,1H3.
What are the key properties of 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine?
4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine has a molecular weight of 276.34 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-phenylmethoxy-5-pyridin-3-ylpyridine is sourced from PubChem (CID 175581548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).