3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol

C18H15NO — CID 134530665

IUPAC3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol
SMILESCc1ccc(/C=C/c2cnc3c(O)cccc3c2)cc1
InChIInChI=1S/C18H15NO/c1-13-5-7-14(8-6-13)9-10-15-11-16-3-2-4-17(20)18(16)19-12-15/h2-12,20H,1H3/b10-9+
InChIKeyBOTVNPPVYYWXRB-MDZDMXLPSA-N
MW261.32 g/mol
LogP4.42
Rot. Bonds2

About 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol

3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol (PubChem CID 134530665) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol.

Molecular Properties

Compound Name3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol
PubChem CID134530665
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol
SMILESCc1ccc(/C=C/c2cnc3c(O)cccc3c2)cc1
InChIInChI=1S/C18H15NO/c1-13-5-7-14(8-6-13)9-10-15-11-16-3-2-4-17(20)18(16)19-12-15/h2-12,20H,1H3/b10-9+
InChIKeyBOTVNPPVYYWXRB-MDZDMXLPSA-N
XLogP4.42
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol?
The IUPAC name of 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol (CID 134530665) is 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol.
What is the SMILES notation for 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol?
The canonical SMILES for 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol is Cc1ccc(/C=C/c2cnc3c(O)cccc3c2)cc1.
What is the InChIKey of 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol?
The InChIKey is BOTVNPPVYYWXRB-MDZDMXLPSA-N. The full InChI is InChI=1S/C18H15NO/c1-13-5-7-14(8-6-13)9-10-15-11-16-3-2-4-17(20)18(16)19-12-15/h2-12,20H,1H3/b10-9+.
What are the key properties of 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol?
3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol has a molecular weight of 261.32 g/mol, XLogP of 4.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol is sourced from PubChem (CID 134530665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).