(7-chloroquinolin-8-yl)methanol

C10H8ClNO — CID 21271234

IUPAC(7-chloroquinolin-8-yl)methanol
SMILESOCc1c(Cl)ccc2cccnc12
InChIInChI=1S/C10H8ClNO/c11-9-4-3-7-2-1-5-12-10(7)8(9)6-13/h1-5,13H,6H2
InChIKeyGAXWGAXWVVGHHI-UHFFFAOYSA-N
MW193.63 g/mol
LogP2.38
Rot. Bonds1

About (7-chloroquinolin-8-yl)methanol

(7-chloroquinolin-8-yl)methanol (PubChem CID 21271234) has the molecular formula C10H8ClNO and a molecular weight of 193.63 g/mol. Its IUPAC name is (7-chloroquinolin-8-yl)methanol.

Molecular Properties

Compound Name(7-chloroquinolin-8-yl)methanol
PubChem CID21271234
Molecular FormulaC10H8ClNO
Molecular Weight193.63 g/mol
Exact Mass193.03
IUPAC Name(7-chloroquinolin-8-yl)methanol
SMILESOCc1c(Cl)ccc2cccnc12
InChIInChI=1S/C10H8ClNO/c11-9-4-3-7-2-1-5-12-10(7)8(9)6-13/h1-5,13H,6H2
InChIKeyGAXWGAXWVVGHHI-UHFFFAOYSA-N
XLogP2.38
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.63
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7-chloroquinolin-8-yl)methanol?
The IUPAC name of (7-chloroquinolin-8-yl)methanol (CID 21271234) is (7-chloroquinolin-8-yl)methanol.
What is the SMILES notation for (7-chloroquinolin-8-yl)methanol?
The canonical SMILES for (7-chloroquinolin-8-yl)methanol is OCc1c(Cl)ccc2cccnc12.
What is the InChIKey of (7-chloroquinolin-8-yl)methanol?
The InChIKey is GAXWGAXWVVGHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNO/c11-9-4-3-7-2-1-5-12-10(7)8(9)6-13/h1-5,13H,6H2.
What are the key properties of (7-chloroquinolin-8-yl)methanol?
(7-chloroquinolin-8-yl)methanol has a molecular weight of 193.63 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-chloroquinolin-8-yl)methanol is sourced from PubChem (CID 21271234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).