(1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol

C10H13NO2 — CID 139891762

IUPAC(1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol
SMILESOCC1CCc2ccccc2N1O
InChIInChI=1S/C10H13NO2/c12-7-9-6-5-8-3-1-2-4-10(8)11(9)13/h1-4,9,12-13H,5-7H2
InChIKeyCTIIONVZCXRJDS-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.19
Rot. Bonds1

About (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol

(1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol (PubChem CID 139891762) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol.

Molecular Properties

Compound Name(1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol
PubChem CID139891762
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name(1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol
SMILESOCC1CCc2ccccc2N1O
InChIInChI=1S/C10H13NO2/c12-7-9-6-5-8-3-1-2-4-10(8)11(9)13/h1-4,9,12-13H,5-7H2
InChIKeyCTIIONVZCXRJDS-UHFFFAOYSA-N
XLogP1.19
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol?
The IUPAC name of (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol (CID 139891762) is (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol.
What is the SMILES notation for (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol?
The canonical SMILES for (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol is OCC1CCc2ccccc2N1O.
What is the InChIKey of (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol?
The InChIKey is CTIIONVZCXRJDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c12-7-9-6-5-8-3-1-2-4-10(8)11(9)13/h1-4,9,12-13H,5-7H2.
What are the key properties of (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol?
(1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol has a molecular weight of 179.22 g/mol, XLogP of 1.19, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-hydroxy-3,4-dihydro-2H-quinolin-2-yl)methanol is sourced from PubChem (CID 139891762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).