7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol

C19H18O2 — CID 63549894

IUPAC7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol
SMILESCc1cc(C)cc(COc2ccc3ccc(O)cc3c2)c1
InChIInChI=1S/C19H18O2/c1-13-7-14(2)9-15(8-13)12-21-19-6-4-16-3-5-18(20)10-17(16)11-19/h3-11,20H,12H2,1-2H3
InChIKeyXBRUILNSSOPJOL-UHFFFAOYSA-N
MW278.35 g/mol
LogP4.74
Rot. Bonds3

About 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol

7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol (PubChem CID 63549894) has the molecular formula C19H18O2 and a molecular weight of 278.35 g/mol. Its IUPAC name is 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol.

Molecular Properties

Compound Name7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol
PubChem CID63549894
Molecular FormulaC19H18O2
Molecular Weight278.35 g/mol
Exact Mass278.13
IUPAC Name7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol
SMILESCc1cc(C)cc(COc2ccc3ccc(O)cc3c2)c1
InChIInChI=1S/C19H18O2/c1-13-7-14(2)9-15(8-13)12-21-19-6-4-16-3-5-18(20)10-17(16)11-19/h3-11,20H,12H2,1-2H3
InChIKeyXBRUILNSSOPJOL-UHFFFAOYSA-N
XLogP4.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-6-[(3,5-dimethylphenyl)methoxy]naphthalene
CID 60624731
6-methylnaphthalen-2-ol;2-methyl-6-phenylmethoxynaphthalene
CID 158113747
7-[(3,4-dichlorophenyl)methoxy]naphthalen-2-ol
CID 43326484
4-[(7-hydroxynaphthalen-2-yl)oxymethyl]benzonitrile
CID 43326483
7-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]naphthalen-2-ol
CID 43326466
2-methyl-7-phenylmethoxynaphthalene
CID 90146760
1,3-dimethyl-5-[(3-methylphenoxy)methyl]benzene
CID 60644540
1-[(4-iodophenoxy)methyl]-3,5-dimethylbenzene
CID 60644543
[3-[(3,5-dimethylphenyl)methoxy]phenyl]boronic acid
CID 54911074
1,3-dimethyl-5-(phenoxymethyl)benzene
CID 20649368
7-(5-hydroxypentoxy)naphthalen-2-ol
CID 62229734
(1S)-1-[4-[(3,5-dimethylphenyl)methoxy]phenyl]ethanol
CID 78930281

Frequently Asked Questions

What is the IUPAC name of 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol?
The IUPAC name of 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol (CID 63549894) is 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol.
What is the SMILES notation for 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol?
The canonical SMILES for 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol is Cc1cc(C)cc(COc2ccc3ccc(O)cc3c2)c1.
What is the InChIKey of 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol?
The InChIKey is XBRUILNSSOPJOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O2/c1-13-7-14(2)9-15(8-13)12-21-19-6-4-16-3-5-18(20)10-17(16)11-19/h3-11,20H,12H2,1-2H3.
What are the key properties of 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol?
7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol has a molecular weight of 278.35 g/mol, XLogP of 4.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol is sourced from PubChem (CID 63549894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).