3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole

C16H14N2O2 — CID 90202469

IUPAC3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole
SMILESCc1ncccc1OCc1ccc(-c2ccon2)cc1
InChIInChI=1S/C16H14N2O2/c1-12-16(3-2-9-17-12)19-11-13-4-6-14(7-5-13)15-8-10-20-18-15/h2-10H,11H2,1H3
InChIKeyHYMOIGJNGVRADX-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.62
Rot. Bonds4

About 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole

3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole (PubChem CID 90202469) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole.

Molecular Properties

Compound Name3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole
PubChem CID90202469
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole
SMILESCc1ncccc1OCc1ccc(-c2ccon2)cc1
InChIInChI=1S/C16H14N2O2/c1-12-16(3-2-9-17-12)19-11-13-4-6-14(7-5-13)15-8-10-20-18-15/h2-10H,11H2,1H3
InChIKeyHYMOIGJNGVRADX-UHFFFAOYSA-N
XLogP3.62
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-[(2,6-dimethylphenoxy)methyl]phenyl]-1,2-oxazole
CID 90202651
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3-[4-(2-methylpropyl)phenyl]-1,2-oxazole
CID 26597218
3-[4-(methoxymethyl)phenyl]-2-methylpyridine
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N-methyl-2-[(2-methyl-3-pyridinyl)oxymethyl]prop-2-en-1-amine
CID 103074948
2-methyl-1-[(2-methyl-3-pyridinyl)oxy]butan-2-ol
CID 114496106
ethane;3-[4-(methoxymethyl)phenyl]-2-methylpyridine
CID 144506103
2-(4-tert-butylphenyl)-3-phenylmethoxypyridine
CID 174613488
3-(2-methoxyethyl)-5-[(2-methyl-3-pyridinyl)oxymethyl]-1,2,4-oxadiazole
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3-(2,2-difluoroethoxy)-2-methylpyridine
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1-iodo-2-[(4-methylphenyl)methoxy]benzene
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2-chloro-3-[(4-iodophenyl)methoxy]pyridine
CID 65476581

Frequently Asked Questions

What is the IUPAC name of 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole?
The IUPAC name of 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole (CID 90202469) is 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole.
What is the SMILES notation for 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole?
The canonical SMILES for 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole is Cc1ncccc1OCc1ccc(-c2ccon2)cc1.
What is the InChIKey of 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole?
The InChIKey is HYMOIGJNGVRADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-12-16(3-2-9-17-12)19-11-13-4-6-14(7-5-13)15-8-10-20-18-15/h2-10H,11H2,1H3.
What are the key properties of 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole?
3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole has a molecular weight of 266.30 g/mol, XLogP of 3.62, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1,2-oxazole is sourced from PubChem (CID 90202469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).