1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol

C17H19NO2 — CID 25027908

IUPAC1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol
SMILESCCN1CC(c2ccc(O)cc2)Cc2ccc(O)cc21
InChIInChI=1S/C17H19NO2/c1-2-18-11-14(12-3-6-15(19)7-4-12)9-13-5-8-16(20)10-17(13)18/h3-8,10,14,19-20H,2,9,11H2,1H3
InChIKeyVUKNMDADKKJFMU-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.26
Rot. Bonds2

About 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol

1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol (PubChem CID 25027908) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol.

Molecular Properties

Compound Name1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol
PubChem CID25027908
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol
SMILESCCN1CC(c2ccc(O)cc2)Cc2ccc(O)cc21
InChIInChI=1S/C17H19NO2/c1-2-18-11-14(12-3-6-15(19)7-4-12)9-13-5-8-16(20)10-17(13)18/h3-8,10,14,19-20H,2,9,11H2,1H3
InChIKeyVUKNMDADKKJFMU-UHFFFAOYSA-N
XLogP3.26
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol?
The IUPAC name of 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol (CID 25027908) is 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol.
What is the SMILES notation for 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol?
The canonical SMILES for 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol is CCN1CC(c2ccc(O)cc2)Cc2ccc(O)cc21.
What is the InChIKey of 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol?
The InChIKey is VUKNMDADKKJFMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-2-18-11-14(12-3-6-15(19)7-4-12)9-13-5-8-16(20)10-17(13)18/h3-8,10,14,19-20H,2,9,11H2,1H3.
What are the key properties of 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol?
1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol has a molecular weight of 269.34 g/mol, XLogP of 3.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(4-hydroxyphenyl)-3,4-dihydro-2H-quinolin-7-ol is sourced from PubChem (CID 25027908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).