2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol

C14H21NO — CID 84623376

IUPAC2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol
SMILESCC(C)c1ccc2c(c1)C(CCO)CCN2
InChIInChI=1S/C14H21NO/c1-10(2)12-3-4-14-13(9-12)11(6-8-16)5-7-15-14/h3-4,9-11,15-16H,5-8H2,1-2H3
InChIKeyCTUBXUUNYQRZKL-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.09
Rot. Bonds3

About 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol

2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol (PubChem CID 84623376) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol.

Molecular Properties

Compound Name2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol
PubChem CID84623376
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol
SMILESCC(C)c1ccc2c(c1)C(CCO)CCN2
InChIInChI=1S/C14H21NO/c1-10(2)12-3-4-14-13(9-12)11(6-8-16)5-7-15-14/h3-4,9-11,15-16H,5-8H2,1-2H3
InChIKeyCTUBXUUNYQRZKL-UHFFFAOYSA-N
XLogP3.09
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol?
The IUPAC name of 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol (CID 84623376) is 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol.
What is the SMILES notation for 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol?
The canonical SMILES for 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol is CC(C)c1ccc2c(c1)C(CCO)CCN2.
What is the InChIKey of 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol?
The InChIKey is CTUBXUUNYQRZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(2)12-3-4-14-13(9-12)11(6-8-16)5-7-15-14/h3-4,9-11,15-16H,5-8H2,1-2H3.
What are the key properties of 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol?
2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol has a molecular weight of 219.33 g/mol, XLogP of 3.09, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-yl)ethanol is sourced from PubChem (CID 84623376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).