3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine

C16H18N2O2 — CID 141109770

IUPAC3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine
SMILESCOc1ccc(C2CC(c3ccncc3)ON2C)cc1
InChIInChI=1S/C16H18N2O2/c1-18-15(12-3-5-14(19-2)6-4-12)11-16(20-18)13-7-9-17-10-8-13/h3-10,15-16H,11H2,1-2H3
InChIKeyKDVRGOZNJGJJAQ-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.14
Rot. Bonds3

About 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine

3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine (PubChem CID 141109770) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine
PubChem CID141109770
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine
SMILESCOc1ccc(C2CC(c3ccncc3)ON2C)cc1
InChIInChI=1S/C16H18N2O2/c1-18-15(12-3-5-14(19-2)6-4-12)11-16(20-18)13-7-9-17-10-8-13/h3-10,15-16H,11H2,1-2H3
InChIKeyKDVRGOZNJGJJAQ-UHFFFAOYSA-N
XLogP3.14
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]pyridine
CID 127245045
5-bromo-3-(4-methoxyphenyl)-2-methyl-3,4-dihydropyrazole
CID 84712363
2-(4-methoxyphenyl)-1-(pyridin-4-ylmethyl)piperazine
CID 110109334
4-[(3R,5S)-5-(4-methoxyphenyl)-2,2-dimethylpyrrolidin-3-yl]pyridine
CID 12621391
2,6-bis(4-methoxyphenyl)-1-methylpiperidin-4-one
CID 14047057
(3S,4S,6R)-6-(4-methoxyphenyl)oxane-3,4-diol
CID 100945532
(2S)-2-(4-methoxyphenyl)-1-methylpyrrolidine
CID 92850085
(5S)-5-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazole
CID 162348675
(2S,4S)-2-(4-methoxyphenyl)-6-phenyl-4-pyridin-4-yl-3,4-dihydro-2H-pyran-5-carbonitrile
CID 101117525
(5R,7S)-5,7-bis(4-methoxyphenyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 135682867
4-[2-[(3R)-3-(4-methoxyphenyl)pyrrolidin-1-yl]ethyl]pyridine
CID 124591492
2-(4-methoxyphenyl)-N-pyridin-4-ylpyrrolidine-1-carboxamide
CID 138993640

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine?
The IUPAC name of 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine (CID 141109770) is 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine.
What is the SMILES notation for 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine?
The canonical SMILES for 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine is COc1ccc(C2CC(c3ccncc3)ON2C)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine?
The InChIKey is KDVRGOZNJGJJAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-18-15(12-3-5-14(19-2)6-4-12)11-16(20-18)13-7-9-17-10-8-13/h3-10,15-16H,11H2,1-2H3.
What are the key properties of 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine?
3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine has a molecular weight of 270.33 g/mol, XLogP of 3.14, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-2-methyl-5-pyridin-4-yl-1,2-oxazolidine is sourced from PubChem (CID 141109770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).