2-(3-methylquinolin-2-yl)ethanol

C12H13NO — CID 154179956

IUPAC2-(3-methylquinolin-2-yl)ethanol
SMILESCc1cc2ccccc2nc1CCO
InChIInChI=1S/C12H13NO/c1-9-8-10-4-2-3-5-12(10)13-11(9)6-7-14/h2-5,8,14H,6-7H2,1H3
InChIKeyWHDFTYMKLQBSHN-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.08
Rot. Bonds2

About 2-(3-methylquinolin-2-yl)ethanol

2-(3-methylquinolin-2-yl)ethanol (PubChem CID 154179956) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-(3-methylquinolin-2-yl)ethanol.

Molecular Properties

Compound Name2-(3-methylquinolin-2-yl)ethanol
PubChem CID154179956
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name2-(3-methylquinolin-2-yl)ethanol
SMILESCc1cc2ccccc2nc1CCO
InChIInChI=1S/C12H13NO/c1-9-8-10-4-2-3-5-12(10)13-11(9)6-7-14/h2-5,8,14H,6-7H2,1H3
InChIKeyWHDFTYMKLQBSHN-UHFFFAOYSA-N
XLogP2.08
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butyl-3-methylquinoline
CID 519104
1-(3-methylquinolin-2-yl)propan-2-ol
CID 63229408
2-(3-methylquinolin-2-yl)acetonitrile
CID 55167268
2-(2-chloropropyl)-3-methylquinoline
CID 63228864
3-methyl-2-[(4-methylpiperidin-1-yl)methyl]quinoline
CID 91331683
2-[ethyl-(3-methylquinolin-2-yl)amino]ethanol
CID 63228987
3,3-dimethyl-1-(3-methylquinolin-2-yl)butan-2-amine
CID 63229243
2-(3-chloroquinoxalin-2-yl)ethanol
CID 166994534
2-(2-chloroquinolin-3-yl)ethanol
CID 116985217
2-(3-methylquinolin-2-yl)-1-piperidin-1-ylethanone
CID 110848885
2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol
CID 89487150
2-(2-chloro-2-cyclopropylethyl)-3-methylquinoline
CID 63352781

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylquinolin-2-yl)ethanol?
The IUPAC name of 2-(3-methylquinolin-2-yl)ethanol (CID 154179956) is 2-(3-methylquinolin-2-yl)ethanol.
What is the SMILES notation for 2-(3-methylquinolin-2-yl)ethanol?
The canonical SMILES for 2-(3-methylquinolin-2-yl)ethanol is Cc1cc2ccccc2nc1CCO.
What is the InChIKey of 2-(3-methylquinolin-2-yl)ethanol?
The InChIKey is WHDFTYMKLQBSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-9-8-10-4-2-3-5-12(10)13-11(9)6-7-14/h2-5,8,14H,6-7H2,1H3.
What are the key properties of 2-(3-methylquinolin-2-yl)ethanol?
2-(3-methylquinolin-2-yl)ethanol has a molecular weight of 187.24 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylquinolin-2-yl)ethanol is sourced from PubChem (CID 154179956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).