1-(4-chlorophenyl)-2-quinolin-2-ylethanol

C17H14ClNO — CID 4525777

IUPAC1-(4-chlorophenyl)-2-quinolin-2-ylethanol
SMILESOC(Cc1ccc2ccccc2n1)c1ccc(Cl)cc1
InChIInChI=1S/C17H14ClNO/c18-14-8-5-13(6-9-14)17(20)11-15-10-7-12-3-1-2-4-16(12)19-15/h1-10,17,20H,11H2
InChIKeyUYZFQPINNBZUER-UHFFFAOYSA-N
MW283.76 g/mol
LogP4.16
Rot. Bonds3

About 1-(4-chlorophenyl)-2-quinolin-2-ylethanol

1-(4-chlorophenyl)-2-quinolin-2-ylethanol (PubChem CID 4525777) has the molecular formula C17H14ClNO and a molecular weight of 283.76 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-quinolin-2-ylethanol.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-quinolin-2-ylethanol
PubChem CID4525777
Molecular FormulaC17H14ClNO
Molecular Weight283.76 g/mol
Exact Mass283.08
IUPAC Name1-(4-chlorophenyl)-2-quinolin-2-ylethanol
SMILESOC(Cc1ccc2ccccc2n1)c1ccc(Cl)cc1
InChIInChI=1S/C17H14ClNO/c18-14-8-5-13(6-9-14)17(20)11-15-10-7-12-3-1-2-4-16(12)19-15/h1-10,17,20H,11H2
InChIKeyUYZFQPINNBZUER-UHFFFAOYSA-N
XLogP4.16
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-quinolin-2-ylethanol?
The IUPAC name of 1-(4-chlorophenyl)-2-quinolin-2-ylethanol (CID 4525777) is 1-(4-chlorophenyl)-2-quinolin-2-ylethanol.
What is the SMILES notation for 1-(4-chlorophenyl)-2-quinolin-2-ylethanol?
The canonical SMILES for 1-(4-chlorophenyl)-2-quinolin-2-ylethanol is OC(Cc1ccc2ccccc2n1)c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-2-quinolin-2-ylethanol?
The InChIKey is UYZFQPINNBZUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClNO/c18-14-8-5-13(6-9-14)17(20)11-15-10-7-12-3-1-2-4-16(12)19-15/h1-10,17,20H,11H2.
What are the key properties of 1-(4-chlorophenyl)-2-quinolin-2-ylethanol?
1-(4-chlorophenyl)-2-quinolin-2-ylethanol has a molecular weight of 283.76 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-quinolin-2-ylethanol is sourced from PubChem (CID 4525777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).