6-methoxy-4-[(Z)-2-phenylethenyl]quinoline

C18H15NO — CID 54610787

IUPAC6-methoxy-4-[(Z)-2-phenylethenyl]quinoline
SMILESCOc1ccc2nccc(/C=C\c3ccccc3)c2c1
InChIInChI=1S/C18H15NO/c1-20-16-9-10-18-17(13-16)15(11-12-19-18)8-7-14-5-3-2-4-6-14/h2-13H,1H3/b8-7-
InChIKeyBIWJAEXFNMKSJF-FPLPWBNLSA-N
MW261.32 g/mol
LogP4.41
Rot. Bonds3

About 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline

6-methoxy-4-[(Z)-2-phenylethenyl]quinoline (PubChem CID 54610787) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline.

Molecular Properties

Compound Name6-methoxy-4-[(Z)-2-phenylethenyl]quinoline
PubChem CID54610787
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name6-methoxy-4-[(Z)-2-phenylethenyl]quinoline
SMILESCOc1ccc2nccc(/C=C\c3ccccc3)c2c1
InChIInChI=1S/C18H15NO/c1-20-16-9-10-18-17(13-16)15(11-12-19-18)8-7-14-5-3-2-4-6-14/h2-13H,1H3/b8-7-
InChIKeyBIWJAEXFNMKSJF-FPLPWBNLSA-N
XLogP4.41
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline?
The IUPAC name of 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline (CID 54610787) is 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline.
What is the SMILES notation for 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline?
The canonical SMILES for 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline is COc1ccc2nccc(/C=C\c3ccccc3)c2c1.
What is the InChIKey of 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline?
The InChIKey is BIWJAEXFNMKSJF-FPLPWBNLSA-N. The full InChI is InChI=1S/C18H15NO/c1-20-16-9-10-18-17(13-16)15(11-12-19-18)8-7-14-5-3-2-4-6-14/h2-13H,1H3/b8-7-.
What are the key properties of 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline?
6-methoxy-4-[(Z)-2-phenylethenyl]quinoline has a molecular weight of 261.32 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-[(Z)-2-phenylethenyl]quinoline is sourced from PubChem (CID 54610787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).