(6,7-dichloro-4-methylquinolin-2-yl)methanol

C11H9Cl2NO — CID 139719790

IUPAC(6,7-dichloro-4-methylquinolin-2-yl)methanol
SMILESCc1cc(CO)nc2cc(Cl)c(Cl)cc12
InChIInChI=1S/C11H9Cl2NO/c1-6-2-7(5-15)14-11-4-10(13)9(12)3-8(6)11/h2-4,15H,5H2,1H3
InChIKeyLWAGSNIBIDIKQM-UHFFFAOYSA-N
MW242.10 g/mol
LogP3.34
Rot. Bonds1

About (6,7-dichloro-4-methylquinolin-2-yl)methanol

(6,7-dichloro-4-methylquinolin-2-yl)methanol (PubChem CID 139719790) has the molecular formula C11H9Cl2NO and a molecular weight of 242.10 g/mol. Its IUPAC name is (6,7-dichloro-4-methylquinolin-2-yl)methanol.

Molecular Properties

Compound Name(6,7-dichloro-4-methylquinolin-2-yl)methanol
PubChem CID139719790
Molecular FormulaC11H9Cl2NO
Molecular Weight242.10 g/mol
Exact Mass241.01
IUPAC Name(6,7-dichloro-4-methylquinolin-2-yl)methanol
SMILESCc1cc(CO)nc2cc(Cl)c(Cl)cc12
InChIInChI=1S/C11H9Cl2NO/c1-6-2-7(5-15)14-11-4-10(13)9(12)3-8(6)11/h2-4,15H,5H2,1H3
InChIKeyLWAGSNIBIDIKQM-UHFFFAOYSA-N
XLogP3.34
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.10
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Reproxalap
CID 16088030
WR 30090
CID 31755
1-[7-Chloro-2-(4-chlorophenyl)-4-quinolinyl]-2-(dibutylamino)ethanol hydrochloride
CID 24185504
2-(Dibutylamino)-1-[6,8-dichloro-2-(4-chlorophenyl)-4-quinolinyl]ethanol hydrochloride
CID 24200355
(2,6-Dichlorophenyl)-quinolin-2-ylmethanol
CID 230487
2-[2,6-Dichloro-4-(2-chlorophenyl)-3-quinolyl]ethanol
CID 53319662
6,7-Dichloro-2-(4-chlorophenyl)-4-(phenylmethoxymethyl)quinoline
CID 155543412
4-Chloro-alpha-(2-quinolinylmethyl)benzyl alcohol
CID 4525777
7-Chloro-2-quinolinemethanol
CID 23359226
(4-Chloroquinolin-2-yl)methanol
CID 53800151
1-[7-Chloro-2-(4-chlorophenyl)quinolin-4-yl]-2-(dibutylamino)ethanol
CID 412601
1-[2-(4-Chlorophenyl)quinolin-4-yl]-2-(dibutylamino)ethanol
CID 412602

Frequently Asked Questions

What is the IUPAC name of (6,7-dichloro-4-methylquinolin-2-yl)methanol?
The IUPAC name of (6,7-dichloro-4-methylquinolin-2-yl)methanol (CID 139719790) is (6,7-dichloro-4-methylquinolin-2-yl)methanol.
What is the SMILES notation for (6,7-dichloro-4-methylquinolin-2-yl)methanol?
The canonical SMILES for (6,7-dichloro-4-methylquinolin-2-yl)methanol is Cc1cc(CO)nc2cc(Cl)c(Cl)cc12.
What is the InChIKey of (6,7-dichloro-4-methylquinolin-2-yl)methanol?
The InChIKey is LWAGSNIBIDIKQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2NO/c1-6-2-7(5-15)14-11-4-10(13)9(12)3-8(6)11/h2-4,15H,5H2,1H3.
What are the key properties of (6,7-dichloro-4-methylquinolin-2-yl)methanol?
(6,7-dichloro-4-methylquinolin-2-yl)methanol has a molecular weight of 242.10 g/mol, XLogP of 3.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6,7-dichloro-4-methylquinolin-2-yl)methanol is sourced from PubChem (CID 139719790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).