3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol

C12H17NO — CID 15260550

IUPAC3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol
SMILESOCCCC1CCc2ccccc2N1
InChIInChI=1S/C12H17NO/c14-9-3-5-11-8-7-10-4-1-2-6-12(10)13-11/h1-2,4,6,11,13-14H,3,5,7-9H2
InChIKeyFHZDPKQBOVCWFM-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.19
Rot. Bonds3

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

3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol (PubChem CID 15260550) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol
PubChem CID15260550
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol
SMILESOCCCC1CCc2ccccc2N1
InChIInChI=1S/C12H17NO/c14-9-3-5-11-8-7-10-4-1-2-6-12(10)13-11/h1-2,4,6,11,13-14H,3,5,7-9H2
InChIKeyFHZDPKQBOVCWFM-UHFFFAOYSA-N
XLogP2.19
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol?
The IUPAC name of 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol (CID 15260550) is 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol.
What is the SMILES notation for 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol?
The canonical SMILES for 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol is OCCCC1CCc2ccccc2N1.
What is the InChIKey of 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol?
The InChIKey is FHZDPKQBOVCWFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c14-9-3-5-11-8-7-10-4-1-2-6-12(10)13-11/h1-2,4,6,11,13-14H,3,5,7-9H2.
What are the key properties of 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol?
3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol has a molecular weight of 191.27 g/mol, XLogP of 2.19, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol is sourced from PubChem (CID 15260550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).