6-(3,4-dimethoxyphenyl)naphthalen-1-ol

C18H16O3 — CID 56648124

IUPAC6-(3,4-dimethoxyphenyl)naphthalen-1-ol
SMILESCOc1ccc(-c2ccc3c(O)cccc3c2)cc1OC
InChIInChI=1S/C18H16O3/c1-20-17-9-7-13(11-18(17)21-2)12-6-8-15-14(10-12)4-3-5-16(15)19/h3-11,19H,1-2H3
InChIKeyIAIGVBSZDHGXIG-UHFFFAOYSA-N
MW280.32 g/mol
LogP4.23
Rot. Bonds3

About 6-(3,4-dimethoxyphenyl)naphthalen-1-ol

6-(3,4-dimethoxyphenyl)naphthalen-1-ol (PubChem CID 56648124) has the molecular formula C18H16O3 and a molecular weight of 280.32 g/mol. Its IUPAC name is 6-(3,4-dimethoxyphenyl)naphthalen-1-ol.

Molecular Properties

Compound Name6-(3,4-dimethoxyphenyl)naphthalen-1-ol
PubChem CID56648124
Molecular FormulaC18H16O3
Molecular Weight280.32 g/mol
Exact Mass280.11
IUPAC Name6-(3,4-dimethoxyphenyl)naphthalen-1-ol
SMILESCOc1ccc(-c2ccc3c(O)cccc3c2)cc1OC
InChIInChI=1S/C18H16O3/c1-20-17-9-7-13(11-18(17)21-2)12-6-8-15-14(10-12)4-3-5-16(15)19/h3-11,19H,1-2H3
InChIKeyIAIGVBSZDHGXIG-UHFFFAOYSA-N
XLogP4.23
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol
CID 56648216
2-(3,4-dimethoxyphenyl)naphthalene
CID 10890732
3-(3,4-dimethoxyphenyl)phenol
CID 39231875
2-methoxy-5-naphthalen-2-ylphenol
CID 53220915
6-[4-(2-hydroxyphenyl)phenyl]naphthalen-1-ol
CID 138695753
6-pyridin-4-ylnaphthalen-1-ol
CID 53321857
5-methoxy-8-methylanthracen-1-ol
CID 19937082
4-(3-bromophenyl)-1,2-dimethoxybenzene
CID 83666367
2-(3,4-dimethoxyphenyl)chromenylium-5,7-diol
CID 134911918
6-(2-methylphenyl)naphthalen-1-ol
CID 71167346
6-(4-hydroxy-3-phenylphenyl)naphthalen-1-ol
CID 56648217
6,7,8-trimethoxynaphthalen-1-ol
CID 15073678

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethoxyphenyl)naphthalen-1-ol?
The IUPAC name of 6-(3,4-dimethoxyphenyl)naphthalen-1-ol (CID 56648124) is 6-(3,4-dimethoxyphenyl)naphthalen-1-ol.
What is the SMILES notation for 6-(3,4-dimethoxyphenyl)naphthalen-1-ol?
The canonical SMILES for 6-(3,4-dimethoxyphenyl)naphthalen-1-ol is COc1ccc(-c2ccc3c(O)cccc3c2)cc1OC.
What is the InChIKey of 6-(3,4-dimethoxyphenyl)naphthalen-1-ol?
The InChIKey is IAIGVBSZDHGXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O3/c1-20-17-9-7-13(11-18(17)21-2)12-6-8-15-14(10-12)4-3-5-16(15)19/h3-11,19H,1-2H3.
What are the key properties of 6-(3,4-dimethoxyphenyl)naphthalen-1-ol?
6-(3,4-dimethoxyphenyl)naphthalen-1-ol has a molecular weight of 280.32 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethoxyphenyl)naphthalen-1-ol is sourced from PubChem (CID 56648124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).