7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol

C22H20N2O3 — CID 70973017

IUPAC7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol
SMILESCCc1ccc2ccc(Cc3ccc4ccc(OC)c(O)c4n3)nc2c1O
InChIInChI=1S/C22H20N2O3/c1-3-13-4-5-14-6-9-16(23-19(14)21(13)25)12-17-10-7-15-8-11-18(27-2)22(26)20(15)24-17/h4-11,25-26H,3,12H2,1-2H3
InChIKeyGTEKDRLRXXMTJK-UHFFFAOYSA-N
MW360.41 g/mol
LogP4.36
Rot. Bonds4

About 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol

7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol (PubChem CID 70973017) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol.

Molecular Properties

Compound Name7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol
PubChem CID70973017
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol
SMILESCCc1ccc2ccc(Cc3ccc4ccc(OC)c(O)c4n3)nc2c1O
InChIInChI=1S/C22H20N2O3/c1-3-13-4-5-14-6-9-16(23-19(14)21(13)25)12-17-10-7-15-8-11-18(27-2)22(26)20(15)24-17/h4-11,25-26H,3,12H2,1-2H3
InChIKeyGTEKDRLRXXMTJK-UHFFFAOYSA-N
XLogP4.36
TPSA75.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 84677805
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CID 117319733
3-ethyl-6-methoxy-2-[2-(methylamino)ethyl]phenol
CID 117299094
3-ethyl-2-[(1-hydroxycyclopropyl)methyl]-6-methoxyphenol
CID 117318322
5-ethyl-8-methoxy-2-(trifluoromethyl)quinoline
CID 143627564
ethane;5-ethyl-8-methoxy-2-(trifluoromethyl)quinoline
CID 143627563
2,9-bis[(4-methoxyphenyl)methyl]-1,10-phenanthroline
CID 67372925
CID 10695390
CID 10695390
2-[(6,7-dimethoxy-1-methylisoquinolin-4-yl)methyl]quinolin-8-ol
CID 90117756
2-amino-1-(6-ethyl-2-hydroxy-3-methoxyphenyl)propan-1-one
CID 84688281
2-amino-2-(6-ethyl-2-hydroxy-3-methoxyphenyl)acetic acid
CID 84689653

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol?
The IUPAC name of 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol (CID 70973017) is 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol.
What is the SMILES notation for 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol?
The canonical SMILES for 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol is CCc1ccc2ccc(Cc3ccc4ccc(OC)c(O)c4n3)nc2c1O.
What is the InChIKey of 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol?
The InChIKey is GTEKDRLRXXMTJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-3-13-4-5-14-6-9-16(23-19(14)21(13)25)12-17-10-7-15-8-11-18(27-2)22(26)20(15)24-17/h4-11,25-26H,3,12H2,1-2H3.
What are the key properties of 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol?
7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol has a molecular weight of 360.41 g/mol, XLogP of 4.36, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol is sourced from PubChem (CID 70973017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).