1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol

C15H14ClNO — CID 91464637

IUPAC1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol
SMILESOc1cccc2c1CCCN2c1ccc(Cl)cc1
InChIInChI=1S/C15H14ClNO/c16-11-6-8-12(9-7-11)17-10-2-3-13-14(17)4-1-5-15(13)18/h1,4-9,18H,2-3,10H2
InChIKeyJSKBCSDPFOPWLC-UHFFFAOYSA-N
MW259.74 g/mol
LogP4.13
Rot. Bonds1

About 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol

1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol (PubChem CID 91464637) has the molecular formula C15H14ClNO and a molecular weight of 259.74 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol.

Molecular Properties

Compound Name1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol
PubChem CID91464637
Molecular FormulaC15H14ClNO
Molecular Weight259.74 g/mol
Exact Mass259.08
IUPAC Name1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol
SMILESOc1cccc2c1CCCN2c1ccc(Cl)cc1
InChIInChI=1S/C15H14ClNO/c16-11-6-8-12(9-7-11)17-10-2-3-13-14(17)4-1-5-15(13)18/h1,4-9,18H,2-3,10H2
InChIKeyJSKBCSDPFOPWLC-UHFFFAOYSA-N
XLogP4.13
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol?
The IUPAC name of 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol (CID 91464637) is 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol.
What is the SMILES notation for 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol?
The canonical SMILES for 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol is Oc1cccc2c1CCCN2c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol?
The InChIKey is JSKBCSDPFOPWLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO/c16-11-6-8-12(9-7-11)17-10-2-3-13-14(17)4-1-5-15(13)18/h1,4-9,18H,2-3,10H2.
What are the key properties of 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol?
1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol has a molecular weight of 259.74 g/mol, XLogP of 4.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-3,4-dihydro-2H-quinolin-5-ol is sourced from PubChem (CID 91464637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).