[4-(2-chlorophenoxy)quinolin-2-yl]methanol

C16H12ClNO2 — CID 63375932

IUPAC[4-(2-chlorophenoxy)quinolin-2-yl]methanol
SMILESOCc1cc(Oc2ccccc2Cl)c2ccccc2n1
InChIInChI=1S/C16H12ClNO2/c17-13-6-2-4-8-15(13)20-16-9-11(10-19)18-14-7-3-1-5-12(14)16/h1-9,19H,10H2
InChIKeyPRIUTGPEMAKYMG-UHFFFAOYSA-N
MW285.73 g/mol
LogP4.17
Rot. Bonds3

About [4-(2-chlorophenoxy)quinolin-2-yl]methanol

[4-(2-chlorophenoxy)quinolin-2-yl]methanol (PubChem CID 63375932) has the molecular formula C16H12ClNO2 and a molecular weight of 285.73 g/mol. Its IUPAC name is [4-(2-chlorophenoxy)quinolin-2-yl]methanol.

Molecular Properties

Compound Name[4-(2-chlorophenoxy)quinolin-2-yl]methanol
PubChem CID63375932
Molecular FormulaC16H12ClNO2
Molecular Weight285.73 g/mol
Exact Mass285.06
IUPAC Name[4-(2-chlorophenoxy)quinolin-2-yl]methanol
SMILESOCc1cc(Oc2ccccc2Cl)c2ccccc2n1
InChIInChI=1S/C16H12ClNO2/c17-13-6-2-4-8-15(13)20-16-9-11(10-19)18-14-7-3-1-5-12(14)16/h1-9,19H,10H2
InChIKeyPRIUTGPEMAKYMG-UHFFFAOYSA-N
XLogP4.17
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

alpha-Pentyl-3-(2-quinolinylmethoxy)benzenemethanol
CID 5059
1-[4-(Quinolin-2-ylmethoxy)phenyl]hexan-1-ol
CID 9797817
2-Chloro-7-methoxyquinoline-3-methanol
CID 828415
8-[3-(2-Chlorophenoxy)propoxy]quinoline
CID 2283001
2-[(E)-2-(5-chloro-2-methoxyphenyl)ethenyl]quinolin-8-ol
CID 5730217
2-Phenoxymethyl-quinoline
CID 13770359
2-[3-(Quinolin-2-ylmethoxy)phenyl]heptan-2-ol
CID 14349135
8-(2,6-Dichlorobenzyloxy)-2-methylquinoline
CID 22113261
Antibacterial agent 96
CID 162652204
Benzenemethanol, 3-(2-quinolinylmethoxy)-
CID 14650410
6-Chloro-2-methoxy-9-phenoxyacridine
CID 345321
2-Chloro-4-methoxyquinoline
CID 12369166

Frequently Asked Questions

What is the IUPAC name of [4-(2-chlorophenoxy)quinolin-2-yl]methanol?
The IUPAC name of [4-(2-chlorophenoxy)quinolin-2-yl]methanol (CID 63375932) is [4-(2-chlorophenoxy)quinolin-2-yl]methanol.
What is the SMILES notation for [4-(2-chlorophenoxy)quinolin-2-yl]methanol?
The canonical SMILES for [4-(2-chlorophenoxy)quinolin-2-yl]methanol is OCc1cc(Oc2ccccc2Cl)c2ccccc2n1.
What is the InChIKey of [4-(2-chlorophenoxy)quinolin-2-yl]methanol?
The InChIKey is PRIUTGPEMAKYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClNO2/c17-13-6-2-4-8-15(13)20-16-9-11(10-19)18-14-7-3-1-5-12(14)16/h1-9,19H,10H2.
What are the key properties of [4-(2-chlorophenoxy)quinolin-2-yl]methanol?
[4-(2-chlorophenoxy)quinolin-2-yl]methanol has a molecular weight of 285.73 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-chlorophenoxy)quinolin-2-yl]methanol is sourced from PubChem (CID 63375932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).