1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol

C15H19NO2 — CID 114754836

IUPAC1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol
SMILESCc1cc(C(O)COC(C)C)nc2ccccc12
InChIInChI=1S/C15H19NO2/c1-10(2)18-9-15(17)14-8-11(3)12-6-4-5-7-13(12)16-14/h4-8,10,15,17H,9H2,1-3H3
InChIKeyFXDFUBDBLTUBIJ-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.00
Rot. Bonds4

About 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol

1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol (PubChem CID 114754836) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol.

Molecular Properties

Compound Name1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol
PubChem CID114754836
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol
SMILESCc1cc(C(O)COC(C)C)nc2ccccc12
InChIInChI=1S/C15H19NO2/c1-10(2)18-9-15(17)14-8-11(3)12-6-4-5-7-13(12)16-14/h4-8,10,15,17H,9H2,1-3H3
InChIKeyFXDFUBDBLTUBIJ-UHFFFAOYSA-N
XLogP3.00
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(4-methylquinolin-2-yl)butan-1-ol
CID 104969389
2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol
CID 114754909
2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol
CID 114754949
N-ethyl-1-(4-methylquinolin-2-yl)ethanamine
CID 114755257
1-(4-methylquinolin-2-yl)-4-(oxolan-2-yl)butan-1-ol
CID 114754924
(4-methoxyphenyl)-(4-methylquinolin-2-yl)methanol
CID 114754870
(3,4-difluorophenyl)-(4-methylquinolin-2-yl)methanol
CID 114754840
N-[1-(4-methylquinolin-2-yl)ethyl]acetamide
CID 175073880
(2-ethylpyrazol-3-yl)-(4-methylquinolin-2-yl)methanol
CID 114754847
[2,2-dimethyl-1-(4-methylquinolin-2-yl)propyl]hydrazine
CID 105279714
[4-methyl-1-(4-methylquinolin-2-yl)pent-4-enyl]hydrazine
CID 105279669
(4-methylquinolin-2-yl)-(oxan-3-yl)methanol
CID 107136237

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol?
The IUPAC name of 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol (CID 114754836) is 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol.
What is the SMILES notation for 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol?
The canonical SMILES for 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol is Cc1cc(C(O)COC(C)C)nc2ccccc12.
What is the InChIKey of 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol?
The InChIKey is FXDFUBDBLTUBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-10(2)18-9-15(17)14-8-11(3)12-6-4-5-7-13(12)16-14/h4-8,10,15,17H,9H2,1-3H3.
What are the key properties of 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol?
1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol has a molecular weight of 245.32 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol is sourced from PubChem (CID 114754836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).