4-[(E)-2-quinolin-4-ylethenyl]phenol

C17H13NO — CID 741423

IUPAC4-[(E)-2-quinolin-4-ylethenyl]phenol
SMILESOc1ccc(/C=C/c2ccnc3ccccc23)cc1
InChIInChI=1S/C17H13NO/c19-15-9-6-13(7-10-15)5-8-14-11-12-18-17-4-2-1-3-16(14)17/h1-12,19H/b8-5+
InChIKeyAMPIAJAEPGYBAA-VMPITWQZSA-N
MW247.30 g/mol
LogP4.11
Rot. Bonds2

About 4-[(E)-2-quinolin-4-ylethenyl]phenol

4-[(E)-2-quinolin-4-ylethenyl]phenol (PubChem CID 741423) has the molecular formula C17H13NO and a molecular weight of 247.30 g/mol. Its IUPAC name is 4-[(E)-2-quinolin-4-ylethenyl]phenol.

Molecular Properties

Compound Name4-[(E)-2-quinolin-4-ylethenyl]phenol
PubChem CID741423
Molecular FormulaC17H13NO
Molecular Weight247.30 g/mol
Exact Mass247.10
IUPAC Name4-[(E)-2-quinolin-4-ylethenyl]phenol
SMILESOc1ccc(/C=C/c2ccnc3ccccc23)cc1
InChIInChI=1S/C17H13NO/c19-15-9-6-13(7-10-15)5-8-14-11-12-18-17-4-2-1-3-16(14)17/h1-12,19H/b8-5+
InChIKeyAMPIAJAEPGYBAA-VMPITWQZSA-N
XLogP4.11
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-quinolin-4-ylethenyl]phenol?
The IUPAC name of 4-[(E)-2-quinolin-4-ylethenyl]phenol (CID 741423) is 4-[(E)-2-quinolin-4-ylethenyl]phenol.
What is the SMILES notation for 4-[(E)-2-quinolin-4-ylethenyl]phenol?
The canonical SMILES for 4-[(E)-2-quinolin-4-ylethenyl]phenol is Oc1ccc(/C=C/c2ccnc3ccccc23)cc1.
What is the InChIKey of 4-[(E)-2-quinolin-4-ylethenyl]phenol?
The InChIKey is AMPIAJAEPGYBAA-VMPITWQZSA-N. The full InChI is InChI=1S/C17H13NO/c19-15-9-6-13(7-10-15)5-8-14-11-12-18-17-4-2-1-3-16(14)17/h1-12,19H/b8-5+.
What are the key properties of 4-[(E)-2-quinolin-4-ylethenyl]phenol?
4-[(E)-2-quinolin-4-ylethenyl]phenol has a molecular weight of 247.30 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-quinolin-4-ylethenyl]phenol is sourced from PubChem (CID 741423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).