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

C17H13NO — CID 6223893

IUPAC3-[(E)-2-quinolin-2-ylethenyl]phenol
SMILESOc1cccc(/C=C/c2ccc3ccccc3n2)c1
InChIInChI=1S/C17H13NO/c19-16-6-3-4-13(12-16)8-10-15-11-9-14-5-1-2-7-17(14)18-15/h1-12,19H/b10-8+
InChIKeyRZENAZZCHMPRHI-CSKARUKUSA-N
MW247.30 g/mol
LogP4.11
Rot. Bonds2

About 3-[(E)-2-quinolin-2-ylethenyl]phenol

3-[(E)-2-quinolin-2-ylethenyl]phenol (PubChem CID 6223893) has the molecular formula C17H13NO and a molecular weight of 247.30 g/mol. Its IUPAC name is 3-[(E)-2-quinolin-2-ylethenyl]phenol.

Molecular Properties

Compound Name3-[(E)-2-quinolin-2-ylethenyl]phenol
PubChem CID6223893
Molecular FormulaC17H13NO
Molecular Weight247.30 g/mol
Exact Mass247.10
IUPAC Name3-[(E)-2-quinolin-2-ylethenyl]phenol
SMILESOc1cccc(/C=C/c2ccc3ccccc3n2)c1
InChIInChI=1S/C17H13NO/c19-16-6-3-4-13(12-16)8-10-15-11-9-14-5-1-2-7-17(14)18-15/h1-12,19H/b10-8+
InChIKeyRZENAZZCHMPRHI-CSKARUKUSA-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 3-[(E)-2-quinolin-2-ylethenyl]phenol?
The IUPAC name of 3-[(E)-2-quinolin-2-ylethenyl]phenol (CID 6223893) is 3-[(E)-2-quinolin-2-ylethenyl]phenol.
What is the SMILES notation for 3-[(E)-2-quinolin-2-ylethenyl]phenol?
The canonical SMILES for 3-[(E)-2-quinolin-2-ylethenyl]phenol is Oc1cccc(/C=C/c2ccc3ccccc3n2)c1.
What is the InChIKey of 3-[(E)-2-quinolin-2-ylethenyl]phenol?
The InChIKey is RZENAZZCHMPRHI-CSKARUKUSA-N. The full InChI is InChI=1S/C17H13NO/c19-16-6-3-4-13(12-16)8-10-15-11-9-14-5-1-2-7-17(14)18-15/h1-12,19H/b10-8+.
What are the key properties of 3-[(E)-2-quinolin-2-ylethenyl]phenol?
3-[(E)-2-quinolin-2-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 3-[(E)-2-quinolin-2-ylethenyl]phenol is sourced from PubChem (CID 6223893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).