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

C12H17NO — CID 79740095

IUPAC2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol
SMILESCC(C)(O)C1CCCc2cccnc21
InChIInChI=1S/C12H17NO/c1-12(2,14)10-7-3-5-9-6-4-8-13-11(9)10/h4,6,8,10,14H,3,5,7H2,1-2H3
InChIKeyMRZUVTJHTUQMID-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.27
Rot. Bonds1

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

2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol (PubChem CID 79740095) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol.

Molecular Properties

Compound Name2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol
PubChem CID79740095
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol
SMILESCC(C)(O)C1CCCc2cccnc21
InChIInChI=1S/C12H17NO/c1-12(2,14)10-7-3-5-9-6-4-8-13-11(9)10/h4,6,8,10,14H,3,5,7H2,1-2H3
InChIKeyMRZUVTJHTUQMID-UHFFFAOYSA-N
XLogP2.27
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropylamino)-2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol
CID 79738513
1-phenyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine
CID 79745553
8-(4-bromo-2-methylpentan-2-yl)-5,6,7,8-tetrahydroquinoline
CID 79738706
2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol
CID 79078513
trimethyl(5,6,7,8-tetrahydroquinolin-8-yl)silane
CID 130535889
(8S)-5,6,7,8-tetrahydroquinolin-8-ol
CID 11480532
1-cyclobutyl-2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-2-ol
CID 113490186
1-(5-fluoro-2-pyridinyl)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
CID 115940678
(8R)-8-fluoro-5,6,7,8-tetrahydroquinoline
CID 162400504
(8S)-8-fluoro-5,6,7,8-tetrahydroquinoline
CID 164583093
4-[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-hydroxyethyl]phenol
CID 83075608
1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanol
CID 79739208

Frequently Asked Questions

What is the IUPAC name of 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol?
The IUPAC name of 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol (CID 79740095) is 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol.
What is the SMILES notation for 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol?
The canonical SMILES for 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol is CC(C)(O)C1CCCc2cccnc21.
What is the InChIKey of 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol?
The InChIKey is MRZUVTJHTUQMID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-12(2,14)10-7-3-5-9-6-4-8-13-11(9)10/h4,6,8,10,14H,3,5,7H2,1-2H3.
What are the key properties of 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol?
2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol has a molecular weight of 191.27 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol is sourced from PubChem (CID 79740095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).