7-phenylmethoxyquinoline;quinolin-7-ol

C25H20N2O2 — CID 160975104

IUPAC7-phenylmethoxyquinoline;quinolin-7-ol
SMILESOc1ccc2cccnc2c1.c1ccc(COc2ccc3cccnc3c2)cc1
InChIInChI=1S/C16H13NO.C9H7NO/c1-2-5-13(6-3-1)12-18-15-9-8-14-7-4-10-17-16(14)11-15;11-8-4-3-7-2-1-5-10-9(7)6-8/h1-11H,12H2;1-6,11H
InChIKeySYTIXAWTLIVGJH-UHFFFAOYSA-N
MW380.45 g/mol
LogP5.75
Rot. Bonds3

About 7-phenylmethoxyquinoline;quinolin-7-ol

7-phenylmethoxyquinoline;quinolin-7-ol (PubChem CID 160975104) has the molecular formula C25H20N2O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is 7-phenylmethoxyquinoline;quinolin-7-ol.

Molecular Properties

Compound Name7-phenylmethoxyquinoline;quinolin-7-ol
PubChem CID160975104
Molecular FormulaC25H20N2O2
Molecular Weight380.45 g/mol
Exact Mass380.15
IUPAC Name7-phenylmethoxyquinoline;quinolin-7-ol
SMILESOc1ccc2cccnc2c1.c1ccc(COc2ccc3cccnc3c2)cc1
InChIInChI=1S/C16H13NO.C9H7NO/c1-2-5-13(6-3-1)12-18-15-9-8-14-7-4-10-17-16(14)11-15;11-8-4-3-7-2-1-5-10-9(7)6-8/h1-11H,12H2;1-6,11H
InChIKeySYTIXAWTLIVGJH-UHFFFAOYSA-N
XLogP5.75
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.45
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-(2-bromoethoxy)quinoline;1,2-dibromoethane;quinolin-7-ol
CID 159602221
quinolin-7-ol;sulfane
CID 174825329
ethane;quinolin-7-ol
CID 143537862
7-[(2-chlorophenyl)methoxy]quinoline
CID 91807412
6-methylnaphthalen-2-ol;2-methyl-6-phenylmethoxynaphthalene
CID 158113747
[4-(quinolin-6-yloxymethyl)phenyl]methanol
CID 110005974
3-(quinolin-7-yloxymethyl)pyridine-2-carbothioamide
CID 107313737
N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine
CID 107314976
7-[(3-bromo-4-methoxyphenyl)methoxy]quinoline
CID 107314495
6-quinolin-7-yloxyhexan-1-ol
CID 107705479
7-[(3-fluorophenoxy)methyl]quinoline
CID 174578180
tetrakis(benzene-1,4-diol);quinoline
CID 174523855

Frequently Asked Questions

What is the IUPAC name of 7-phenylmethoxyquinoline;quinolin-7-ol?
The IUPAC name of 7-phenylmethoxyquinoline;quinolin-7-ol (CID 160975104) is 7-phenylmethoxyquinoline;quinolin-7-ol.
What is the SMILES notation for 7-phenylmethoxyquinoline;quinolin-7-ol?
The canonical SMILES for 7-phenylmethoxyquinoline;quinolin-7-ol is Oc1ccc2cccnc2c1.c1ccc(COc2ccc3cccnc3c2)cc1.
What is the InChIKey of 7-phenylmethoxyquinoline;quinolin-7-ol?
The InChIKey is SYTIXAWTLIVGJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO.C9H7NO/c1-2-5-13(6-3-1)12-18-15-9-8-14-7-4-10-17-16(14)11-15;11-8-4-3-7-2-1-5-10-9(7)6-8/h1-11H,12H2;1-6,11H.
What are the key properties of 7-phenylmethoxyquinoline;quinolin-7-ol?
7-phenylmethoxyquinoline;quinolin-7-ol has a molecular weight of 380.45 g/mol, XLogP of 5.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylmethoxyquinoline;quinolin-7-ol is sourced from PubChem (CID 160975104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).