6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol

C23H19NO2 — CID 145481416

IUPAC6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol
SMILESCNc1ccc(-c2c(O)ccc3cc(-c4cccc(O)c4)ccc23)cc1
InChIInChI=1S/C23H19NO2/c1-24-19-9-5-15(6-10-19)23-21-11-7-17(13-18(21)8-12-22(23)26)16-3-2-4-20(25)14-16/h2-14,24-26H,1H3
InChIKeyYSCVQXFSMGHOKM-UHFFFAOYSA-N
MW341.41 g/mol
LogP5.63
Rot. Bonds3

About 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol

6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol (PubChem CID 145481416) has the molecular formula C23H19NO2 and a molecular weight of 341.41 g/mol. Its IUPAC name is 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol.

Molecular Properties

Compound Name6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol
PubChem CID145481416
Molecular FormulaC23H19NO2
Molecular Weight341.41 g/mol
Exact Mass341.14
IUPAC Name6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol
SMILESCNc1ccc(-c2c(O)ccc3cc(-c4cccc(O)c4)ccc23)cc1
InChIInChI=1S/C23H19NO2/c1-24-19-9-5-15(6-10-19)23-21-11-7-17(13-18(21)8-12-22(23)26)16-3-2-4-20(25)14-16/h2-14,24-26H,1H3
InChIKeyYSCVQXFSMGHOKM-UHFFFAOYSA-N
XLogP5.63
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.41
LogP ≤ 55.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol;4-oxobutanoic acid
CID 145481415
6-(3-hydroxyphenyl)-1-pyridin-3-ylnaphthalen-2-ol
CID 24970356
3-[2-hydroxy-6-(3-hydroxyphenyl)naphthalen-1-yl]benzoic acid
CID 25069442
4-fluoro-N-[3-[2-hydroxy-6-(3-hydroxyphenyl)naphthalen-1-yl]phenyl]benzenesulfonamide
CID 57384262
3-[2-hydroxy-6-(3-hydroxyphenyl)naphthalen-1-yl]-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 59443442
3-[2-hydroxy-6-(3-hydroxyphenyl)naphthalen-1-yl]-N-(1,3-thiazol-2-yl)benzamide
CID 25072940
5-chloro-N-[3-[2-hydroxy-6-(3-hydroxyphenyl)naphthalen-1-yl]phenyl]thiophene-2-sulfonamide
CID 25073246
1-phenylnaphthalene-2,7-diol
CID 118054370
(E)-3-[2-hydroxy-6-(3-hydroxyphenyl)naphthalen-1-yl]-N-phenylprop-2-enamide
CID 24949869
3-anthracen-9-ylphenol
CID 91210590
6-(6-hydroxy-5-methylnaphthalen-2-yl)-1-methylnaphthalen-2-ol
CID 153453254
5-(methylamino)naphthalen-2-ol
CID 74890550

Frequently Asked Questions

What is the IUPAC name of 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol?
The IUPAC name of 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol (CID 145481416) is 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol.
What is the SMILES notation for 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol?
The canonical SMILES for 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol is CNc1ccc(-c2c(O)ccc3cc(-c4cccc(O)c4)ccc23)cc1.
What is the InChIKey of 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol?
The InChIKey is YSCVQXFSMGHOKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO2/c1-24-19-9-5-15(6-10-19)23-21-11-7-17(13-18(21)8-12-22(23)26)16-3-2-4-20(25)14-16/h2-14,24-26H,1H3.
What are the key properties of 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol?
6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol has a molecular weight of 341.41 g/mol, XLogP of 5.63, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-hydroxyphenyl)-1-[4-(methylamino)phenyl]naphthalen-2-ol is sourced from PubChem (CID 145481416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).