2-chloroquinolin-7-ol

C9H6ClNO — CID 135427710

IUPAC2-chloroquinolin-7-ol
SMILESOc1ccc2ccc(Cl)nc2c1
InChIInChI=1S/C9H6ClNO/c10-9-4-2-6-1-3-7(12)5-8(6)11-9/h1-5,12H
InChIKeyOKRDYODLCPEIMP-UHFFFAOYSA-N
MW179.61 g/mol
LogP2.59
Rot. Bonds

About 2-chloroquinolin-7-ol

2-chloroquinolin-7-ol (PubChem CID 135427710) has the molecular formula C9H6ClNO and a molecular weight of 179.61 g/mol. Its IUPAC name is 2-chloroquinolin-7-ol.

Molecular Properties

Compound Name2-chloroquinolin-7-ol
PubChem CID135427710
Molecular FormulaC9H6ClNO
Molecular Weight179.61 g/mol
Exact Mass179.01
IUPAC Name2-chloroquinolin-7-ol
SMILESOc1ccc2ccc(Cl)nc2c1
InChIInChI=1S/C9H6ClNO/c10-9-4-2-6-1-3-7(12)5-8(6)11-9/h1-5,12H
InChIKeyOKRDYODLCPEIMP-UHFFFAOYSA-N
XLogP2.59
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.61
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-(trifluoromethyl)quinolin-7-ol
CID 135463587
2-chloro-N,N-dimethylquinolin-7-amine
CID 14140499
(2-chloroquinolin-7-yl) acetate
CID 174716501
2-chloro-7-hydroxyquinoline-6-carboxamide
CID 151025538
2-(diazomethyl)quinolin-7-ol
CID 136824757
2-(phosphanylideneamino)quinolin-7-ol
CID 135999438
quinolin-7-ol;sulfane
CID 174825329
7-bromo-2-chloroquinoline;2-methylpropan-2-amine
CID 135311981
2-aminoquinazolin-7-ol
CID 141030840
ethane;quinolin-7-ol
CID 143537862
2-chloro-1,6-naphthyridin-7-amine
CID 138605042
2-chloro-1,7-naphthyridine
CID 20696625

Frequently Asked Questions

What is the IUPAC name of 2-chloroquinolin-7-ol?
The IUPAC name of 2-chloroquinolin-7-ol (CID 135427710) is 2-chloroquinolin-7-ol.
What is the SMILES notation for 2-chloroquinolin-7-ol?
The canonical SMILES for 2-chloroquinolin-7-ol is Oc1ccc2ccc(Cl)nc2c1.
What is the InChIKey of 2-chloroquinolin-7-ol?
The InChIKey is OKRDYODLCPEIMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClNO/c10-9-4-2-6-1-3-7(12)5-8(6)11-9/h1-5,12H.
What are the key properties of 2-chloroquinolin-7-ol?
2-chloroquinolin-7-ol has a molecular weight of 179.61 g/mol, XLogP of 2.59, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloroquinolin-7-ol is sourced from PubChem (CID 135427710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).