6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol

C50H32N2O4 — CID 136707669

IUPAC6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1c(O)ccc2cc(-c3ccc(-c4ccc(-c5ccc6c(-c7c(O)ccc8ccccc78)c(O)ccc6c5)cn4)nc3)ccc12
InChIInChI=1S/C50H32N2O4/c53-43-21-13-29-5-1-3-7-37(29)47(43)49-39-17-9-31(25-33(39)15-23-45(49)55)35-11-19-41(51-27-35)42-20-12-36(28-52-42)32-10-18-40-34(26-32)16-24-46(56)50(40)48-38-8-4-2-6-30(38)14-22-44(48)54/h1-28,53-56H
InChIKeyHZIFHVNUTJBKJD-UHFFFAOYSA-N
MW724.82 g/mol
LogP12.25
Rot. Bonds5

About 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol

6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol (PubChem CID 136707669) has the molecular formula C50H32N2O4 and a molecular weight of 724.82 g/mol. Its IUPAC name is 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol.

Molecular Properties

Compound Name6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
PubChem CID136707669
Molecular FormulaC50H32N2O4
Molecular Weight724.82 g/mol
Exact Mass724.24
IUPAC Name6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1c(O)ccc2cc(-c3ccc(-c4ccc(-c5ccc6c(-c7c(O)ccc8ccccc78)c(O)ccc6c5)cn4)nc3)ccc12
InChIInChI=1S/C50H32N2O4/c53-43-21-13-29-5-1-3-7-37(29)47(43)49-39-17-9-31(25-33(39)15-23-45(49)55)35-11-19-41(51-27-35)42-20-12-36(28-52-42)32-10-18-40-34(26-32)16-24-46(56)50(40)48-38-8-4-2-6-30(38)14-22-44(48)54/h1-28,53-56H
InChIKeyHZIFHVNUTJBKJD-UHFFFAOYSA-N
XLogP12.25
TPSA106.70 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500724.82
LogP ≤ 512.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol with MolForge

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Related Compounds

6-Pyridin-3-ylnaphthalen-2-ol
CID 11514074
6-[4-(Pyridin-4-ylmethyl)phenyl]naphthalen-2-ol
CID 46901929
1-[[Ethyl(pyridin-4-ylmethyl)amino]methyl]naphthalen-2-ol
CID 2396090
Dibenzo[f,h]quinolin-7-ol
CID 219962
2-(3-Pyridylmethyl)-1-naphthol
CID 15617838
6-(3-Hydroxyphenyl)-1-(pyridin-3-yl)-2-naphthol
CID 24970356
6-(3-Hydroxyphenyl)-1-(pyridin-4-yl)-2-naphthol
CID 135955190
3-(4-Phenyl-6-pyridin-4-yl-2-pyridinyl)phenol
CID 46861757
3-(2-Phenyl-6-pyridin-4-yl-4-pyridinyl)phenol
CID 46887284
1-(Quinolin-3-ylaminomethyl)-naphthalen-2-ol
CID 951184
2-Pyridin-2-ylmethyl-naphthalen-1-ol
CID 15617857
2-Pyridin-4-ylmethyl-naphthalen-1-ol
CID 15617862

Frequently Asked Questions

What is the IUPAC name of 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol?
The IUPAC name of 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol (CID 136707669) is 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol.
What is the SMILES notation for 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol?
The canonical SMILES for 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol is Oc1ccc2ccccc2c1-c1c(O)ccc2cc(-c3ccc(-c4ccc(-c5ccc6c(-c7c(O)ccc8ccccc78)c(O)ccc6c5)cn4)nc3)ccc12.
What is the InChIKey of 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol?
The InChIKey is HZIFHVNUTJBKJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32N2O4/c53-43-21-13-29-5-1-3-7-37(29)47(43)49-39-17-9-31(25-33(39)15-23-45(49)55)35-11-19-41(51-27-35)42-20-12-36(28-52-42)32-10-18-40-34(26-32)16-24-46(56)50(40)48-38-8-4-2-6-30(38)14-22-44(48)54/h1-28,53-56H.
What are the key properties of 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol?
6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol has a molecular weight of 724.82 g/mol, XLogP of 12.25, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-[5-[6-hydroxy-5-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-2-pyridinyl]-3-pyridinyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol is sourced from PubChem (CID 136707669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).