(1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol

C17H17NO3 — CID 78933872

IUPAC(1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol
SMILESCc1cc(COc2c([C@@H](C)O)ccc3ccccc23)on1
InChIInChI=1S/C17H17NO3/c1-11-9-14(21-18-11)10-20-17-15(12(2)19)8-7-13-5-3-4-6-16(13)17/h3-9,12,19H,10H2,1-2H3/t12-/m1/s1
InChIKeyMXPJSRBEASVRCT-GFCCVEGCSA-N
MW283.33 g/mol
LogP3.77
Rot. Bonds4

About (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol

(1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol (PubChem CID 78933872) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol
PubChem CID78933872
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Name(1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol
SMILESCc1cc(COc2c([C@@H](C)O)ccc3ccccc23)on1
InChIInChI=1S/C17H17NO3/c1-11-9-14(21-18-11)10-20-17-15(12(2)19)8-7-13-5-3-4-6-16(13)17/h3-9,12,19H,10H2,1-2H3/t12-/m1/s1
InChIKeyMXPJSRBEASVRCT-GFCCVEGCSA-N
XLogP3.77
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[3-[2,6-Dimethyl-4-(p-tolyl)phenoxy]propyl]-3-methyl-isoxazole
CID 515982
5-[3-[4-(3-Methoxyphenyl)-2,6-dimethyl-phenoxy]propyl]-3-methyl-isoxazole
CID 515983
3-[3,5-Dimethyl-4-[3-(3-methylisoxazol-5-yl)propoxy]phenyl]phenol
CID 515985
4-[3,5-Dimethyl-4-[3-(3-methylisoxazol-5-yl)propoxy]phenyl]phenol
CID 515986
[3-[3,5-Dimethyl-4-[3-(3-methylisoxazol-5-yl)propoxy]phenyl]phenyl]methanol
CID 515987
(3,5-Dimethyl-1,2-oxazol-4-yl)methyl 2-(5-methyl-2-propan-2-ylphenoxy)acetate
CID 2997754
5-[3-[4-(3,4-Dimethylphenyl)-2,6-dimethylphenoxy]propyl]-3-methyl-1,2-oxazole
CID 11695975
5-[3-[2,6-Dimethyl-4-(2-methylphenyl)phenoxy]propyl]-3-methyl-1,2-oxazole
CID 44427665
5-[3-(2,6-Dimethyl-4-naphthalen-1-ylphenoxy)propyl]-3-methyl-1,2-oxazole
CID 44427666
2,5,7,8-Tetramethyl-2-[(3-phenyl-1,2-oxazol-5-yl)methoxymethyl]chromen-6-ol
CID 56659343
2,5,7,8-Tetramethyl-2-(3-phenyl-1,2-oxazol-5-yl)-3,4-dihydrochromen-6-ol
CID 56666275
2-[[3-(4-Methoxyphenyl)-1,2-oxazol-5-yl]methoxymethyl]-2,5,7,8-tetramethylchromen-6-ol
CID 56669686

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol?
The IUPAC name of (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol (CID 78933872) is (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol.
What is the SMILES notation for (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol?
The canonical SMILES for (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol is Cc1cc(COc2c([C@@H](C)O)ccc3ccccc23)on1.
What is the InChIKey of (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol?
The InChIKey is MXPJSRBEASVRCT-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H17NO3/c1-11-9-14(21-18-11)10-20-17-15(12(2)19)8-7-13-5-3-4-6-16(13)17/h3-9,12,19H,10H2,1-2H3/t12-/m1/s1.
What are the key properties of (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol?
(1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol has a molecular weight of 283.33 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanol is sourced from PubChem (CID 78933872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).