[2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol

C14H21NO3 — CID 82119498

IUPAC[2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol
SMILESCOc1ccccc1C1OC(CO)CN1C(C)C
InChIInChI=1S/C14H21NO3/c1-10(2)15-8-11(9-16)18-14(15)12-6-4-5-7-13(12)17-3/h4-7,10-11,14,16H,8-9H2,1-3H3
InChIKeyJUQVGQWMBPMJEI-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.80
Rot. Bonds4

About [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol

[2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol (PubChem CID 82119498) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol.

Molecular Properties

Compound Name[2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol
PubChem CID82119498
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name[2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol
SMILESCOc1ccccc1C1OC(CO)CN1C(C)C
InChIInChI=1S/C14H21NO3/c1-10(2)15-8-11(9-16)18-14(15)12-6-4-5-7-13(12)17-3/h4-7,10-11,14,16H,8-9H2,1-3H3
InChIKeyJUQVGQWMBPMJEI-UHFFFAOYSA-N
XLogP1.80
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(4-ethylphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol
CID 82119193
[2-(2-fluorophenyl)-3-(2-methylpropyl)-1,3-oxazolidin-5-yl]methanol
CID 82119884
[4-(2-methoxyphenyl)sulfonyl-6-methylmorpholin-2-yl]methanol
CID 102934895
(2R)-2-(2-methoxyphenyl)-1-propan-2-ylpyrrolidine
CID 124500768
(2S)-2-(2-methoxyphenyl)-1-propan-2-ylpyrrolidine
CID 124500769
[(2S,5S)-3-(3-methylbutyl)-2-phenyl-1,3-oxazolidin-5-yl]methanol
CID 125494670
(2R,4R)-4-(chloromethyl)-2-(2-methoxyphenyl)-1,3-dioxolane
CID 36690087
[(3R,4R)-1-benzyl-4-(2-methoxyphenyl)pyrrolidin-3-yl]methanol
CID 67782895
4-hydroxy-3-(2-methoxyphenyl)-1-propan-2-ylpyrrolidin-2-one
CID 118535332
[4-(2-methoxyphenyl)pyrrolidin-2-yl]methanol
CID 117270818
1-(furan-2-carbonyl)-4-(2-methoxyphenyl)-N-(3-methylbutyl)pyrrolidine-3-carboxamide
CID 42829633
1-(cyclopropanecarbonyl)-4-(2-methoxyphenyl)-N-(3-methylbutyl)pyrrolidine-3-carboxamide
CID 42829641

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol?
The IUPAC name of [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol (CID 82119498) is [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol.
What is the SMILES notation for [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol?
The canonical SMILES for [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol is COc1ccccc1C1OC(CO)CN1C(C)C.
What is the InChIKey of [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol?
The InChIKey is JUQVGQWMBPMJEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-10(2)15-8-11(9-16)18-14(15)12-6-4-5-7-13(12)17-3/h4-7,10-11,14,16H,8-9H2,1-3H3.
What are the key properties of [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol?
[2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol has a molecular weight of 251.33 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyphenyl)-3-propan-2-yl-1,3-oxazolidin-5-yl]methanol is sourced from PubChem (CID 82119498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).