5-ethyl-4-methoxy-2-phenylquinoline

C18H17NO — CID 10400536

IUPAC5-ethyl-4-methoxy-2-phenylquinoline
SMILESCCc1cccc2nc(-c3ccccc3)cc(OC)c12
InChIInChI=1S/C18H17NO/c1-3-13-10-7-11-15-18(13)17(20-2)12-16(19-15)14-8-5-4-6-9-14/h4-12H,3H2,1-2H3
InChIKeyKDJFRTZMMWCXSS-UHFFFAOYSA-N
MW263.34 g/mol
LogP4.47
Rot. Bonds3

About 5-ethyl-4-methoxy-2-phenylquinoline

5-ethyl-4-methoxy-2-phenylquinoline (PubChem CID 10400536) has the molecular formula C18H17NO and a molecular weight of 263.34 g/mol. Its IUPAC name is 5-ethyl-4-methoxy-2-phenylquinoline.

Molecular Properties

Compound Name5-ethyl-4-methoxy-2-phenylquinoline
PubChem CID10400536
Molecular FormulaC18H17NO
Molecular Weight263.34 g/mol
Exact Mass263.13
IUPAC Name5-ethyl-4-methoxy-2-phenylquinoline
SMILESCCc1cccc2nc(-c3ccccc3)cc(OC)c12
InChIInChI=1S/C18H17NO/c1-3-13-10-7-11-15-18(13)17(20-2)12-16(19-15)14-8-5-4-6-9-14/h4-12H,3H2,1-2H3
InChIKeyKDJFRTZMMWCXSS-UHFFFAOYSA-N
XLogP4.47
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methoxy-2-phenylquinoline?
The IUPAC name of 5-ethyl-4-methoxy-2-phenylquinoline (CID 10400536) is 5-ethyl-4-methoxy-2-phenylquinoline.
What is the SMILES notation for 5-ethyl-4-methoxy-2-phenylquinoline?
The canonical SMILES for 5-ethyl-4-methoxy-2-phenylquinoline is CCc1cccc2nc(-c3ccccc3)cc(OC)c12.
What is the InChIKey of 5-ethyl-4-methoxy-2-phenylquinoline?
The InChIKey is KDJFRTZMMWCXSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO/c1-3-13-10-7-11-15-18(13)17(20-2)12-16(19-15)14-8-5-4-6-9-14/h4-12H,3H2,1-2H3.
What are the key properties of 5-ethyl-4-methoxy-2-phenylquinoline?
5-ethyl-4-methoxy-2-phenylquinoline has a molecular weight of 263.34 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methoxy-2-phenylquinoline is sourced from PubChem (CID 10400536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).