5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide

C26H18ClN3O4 — CID 143083672

IUPAC5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide
SMILESCOc1cc2nccc(Oc3ccc4ccc(NC(=O)c5cncc(Cl)c5)cc4c3)c2cc1O
InChIInChI=1S/C26H18ClN3O4/c1-33-25-12-22-21(11-23(25)31)24(6-7-29-22)34-20-5-3-15-2-4-19(9-16(15)10-20)30-26(32)17-8-18(27)14-28-13-17/h2-14,31H,1H3,(H,30,32)
InChIKeyFRTSFGTZCVVZPP-UHFFFAOYSA-N
MW471.90 g/mol
LogP6.20
Rot. Bonds5

About 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide

5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide (PubChem CID 143083672) has the molecular formula C26H18ClN3O4 and a molecular weight of 471.90 g/mol. Its IUPAC name is 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide
PubChem CID143083672
Molecular FormulaC26H18ClN3O4
Molecular Weight471.90 g/mol
Exact Mass471.10
IUPAC Name5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide
SMILESCOc1cc2nccc(Oc3ccc4ccc(NC(=O)c5cncc(Cl)c5)cc4c3)c2cc1O
InChIInChI=1S/C26H18ClN3O4/c1-33-25-12-22-21(11-23(25)31)24(6-7-29-22)34-20-5-3-15-2-4-19(9-16(15)10-20)30-26(32)17-8-18(27)14-28-13-17/h2-14,31H,1H3,(H,30,32)
InChIKeyFRTSFGTZCVVZPP-UHFFFAOYSA-N
XLogP6.20
TPSA93.57 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.90
LogP ≤ 56.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-2-yl]-2-methoxybenzamide
CID 59813624
2,4-dichloro-N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-2-yl]benzamide
CID 59813761
N-(3,4-difluorophenyl)-6-(6,7-dimethoxyquinolin-4-yl)oxyquinoline-3-carboxamide
CID 59813469
7-(6,7-dimethoxyquinolin-4-yl)oxy-N-[4-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
CID 11387053
N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-2-yl]-2-methyl-1,3-thiazole-4-carboxamide
CID 59813538
N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]pyridine-3-carboxamide
CID 22132777
7-(6,7-dimethoxyquinolin-4-yl)oxy-N-[3-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
CID 11376060
N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-2-yl]-2,3-difluorobenzamide
CID 59813365
methyl 4-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamoyl]benzoate
CID 22132633
N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-2-yl]-3-ethoxythiophene-2-carboxamide
CID 59813597
N-[6-[7-[2-(dimethylamino)ethoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-2-yl]benzamide;ethane;molecular hydrogen
CID 143083731
N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-1-yl]pyridine-3-carboxamide
CID 59813488

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide (CID 143083672) is 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide is COc1cc2nccc(Oc3ccc4ccc(NC(=O)c5cncc(Cl)c5)cc4c3)c2cc1O.
What is the InChIKey of 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide?
The InChIKey is FRTSFGTZCVVZPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18ClN3O4/c1-33-25-12-22-21(11-23(25)31)24(6-7-29-22)34-20-5-3-15-2-4-19(9-16(15)10-20)30-26(32)17-8-18(27)14-28-13-17/h2-14,31H,1H3,(H,30,32).
What are the key properties of 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide?
5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide has a molecular weight of 471.90 g/mol, XLogP of 6.20, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[7-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 143083672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).