5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline

C27H18N2O — CID 176757300

IUPAC5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline
SMILESCc1ccc2cc(-c3cccnc3-c3cc4ccoc4c4ncccc34)ccc2c1
InChIInChI=1S/C27H18N2O/c1-17-6-7-19-15-20(9-8-18(19)14-17)22-4-2-11-28-25(22)24-16-21-10-13-30-27(21)26-23(24)5-3-12-29-26/h2-16H,1H3
InChIKeyYFONPGALDPFXHE-UHFFFAOYSA-N
MW386.45 g/mol
LogP7.17
Rot. Bonds2

About 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline

5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline (PubChem CID 176757300) has the molecular formula C27H18N2O and a molecular weight of 386.45 g/mol. Its IUPAC name is 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline.

Molecular Properties

Compound Name5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline
PubChem CID176757300
Molecular FormulaC27H18N2O
Molecular Weight386.45 g/mol
Exact Mass386.14
IUPAC Name5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline
SMILESCc1ccc2cc(-c3cccnc3-c3cc4ccoc4c4ncccc34)ccc2c1
InChIInChI=1S/C27H18N2O/c1-17-6-7-19-15-20(9-8-18(19)14-17)22-4-2-11-28-25(22)24-16-21-10-13-30-27(21)26-23(24)5-3-12-29-26/h2-16H,1H3
InChIKeyYFONPGALDPFXHE-UHFFFAOYSA-N
XLogP7.17
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.45
LogP ≤ 57.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline?
The IUPAC name of 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline (CID 176757300) is 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline.
What is the SMILES notation for 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline?
The canonical SMILES for 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline is Cc1ccc2cc(-c3cccnc3-c3cc4ccoc4c4ncccc34)ccc2c1.
What is the InChIKey of 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline?
The InChIKey is YFONPGALDPFXHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H18N2O/c1-17-6-7-19-15-20(9-8-18(19)14-17)22-4-2-11-28-25(22)24-16-21-10-13-30-27(21)26-23(24)5-3-12-29-26/h2-16H,1H3.
What are the key properties of 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline?
5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline has a molecular weight of 386.45 g/mol, XLogP of 7.17, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(6-methylnaphthalen-2-yl)-2-pyridinyl]furo[3,2-h]quinoline is sourced from PubChem (CID 176757300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).