5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol

C14H21NO — CID 14614407

IUPAC5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol
SMILESCC(O)CCCc1ccc2c(n1)CCCC2
InChIInChI=1S/C14H21NO/c1-11(16)5-4-7-13-10-9-12-6-2-3-8-14(12)15-13/h9-11,16H,2-8H2,1H3
InChIKeyOGZPYLZJJKUWPG-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.66
Rot. Bonds4

About 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol

5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol (PubChem CID 14614407) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol.

Molecular Properties

Compound Name5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol
PubChem CID14614407
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol
SMILESCC(O)CCCc1ccc2c(n1)CCCC2
InChIInChI=1S/C14H21NO/c1-11(16)5-4-7-13-10-9-12-6-2-3-8-14(12)15-13/h9-11,16H,2-8H2,1H3
InChIKeyOGZPYLZJJKUWPG-UHFFFAOYSA-N
XLogP2.66
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol?
The IUPAC name of 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol (CID 14614407) is 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol.
What is the SMILES notation for 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol?
The canonical SMILES for 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol is CC(O)CCCc1ccc2c(n1)CCCC2.
What is the InChIKey of 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol?
The InChIKey is OGZPYLZJJKUWPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11(16)5-4-7-13-10-9-12-6-2-3-8-14(12)15-13/h9-11,16H,2-8H2,1H3.
What are the key properties of 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol?
5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol has a molecular weight of 219.33 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5,6,7,8-tetrahydroquinolin-2-yl)pentan-2-ol is sourced from PubChem (CID 14614407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).