2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol

C15H15NO — CID 69017976

IUPAC2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol
SMILESOc1ccccc1-c1cccc2c1CCCN2
InChIInChI=1S/C15H15NO/c17-15-9-2-1-5-13(15)11-6-3-8-14-12(11)7-4-10-16-14/h1-3,5-6,8-9,16-17H,4,7,10H2
InChIKeyVQNPWFBPXNMXEB-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.42
Rot. Bonds1

About 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol

2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol (PubChem CID 69017976) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol.

Molecular Properties

Compound Name2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol
PubChem CID69017976
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol
SMILESOc1ccccc1-c1cccc2c1CCCN2
InChIInChI=1S/C15H15NO/c17-15-9-2-1-5-13(15)11-6-3-8-14-12(11)7-4-10-16-14/h1-3,5-6,8-9,16-17H,4,7,10H2
InChIKeyVQNPWFBPXNMXEB-UHFFFAOYSA-N
XLogP3.42
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-cyclobutylphenyl)-1,2,3,4-tetrahydroquinoline
CID 114606069
5-pyridin-3-yl-1,2,3,4-tetrahydroquinoline;hydrochloride
CID 169122125
2-(1,2,3,4-tetrahydroquinolin-5-yl)-1,3-thiazole
CID 135387685
5-(4-phenyl-1,2,4-triazol-3-yl)-1,2,3,4-tetrahydroquinoline
CID 62711092
5-(2-phenylethyl)-1,2,3,4-tetrahydroquinoline
CID 106777836
1,2,3,4-tetrahydroquinolin-5-ylmethanamine;dihydrochloride
CID 43810457
5-methoxy-1,2,3,4-tetrahydroquinoline;dihydrochloride
CID 133058760
5-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)-1,2,3,4-tetrahydroquinoline
CID 61336403
1,2,3,4,5,6-hexahydro-1,6-benzodiazocine
CID 2771763
cyclopropyl(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 116610491
5-(4-fluoro-1H-benzimidazol-2-yl)-1,2,3,4-tetrahydroquinoline
CID 60837691
2-(1,2,3,4-tetrahydroquinolin-5-yl)-[1,3]thiazolo[5,4-b]pyridine
CID 65335790

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol?
The IUPAC name of 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol (CID 69017976) is 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol.
What is the SMILES notation for 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol?
The canonical SMILES for 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol is Oc1ccccc1-c1cccc2c1CCCN2.
What is the InChIKey of 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol?
The InChIKey is VQNPWFBPXNMXEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c17-15-9-2-1-5-13(15)11-6-3-8-14-12(11)7-4-10-16-14/h1-3,5-6,8-9,16-17H,4,7,10H2.
What are the key properties of 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol?
2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol has a molecular weight of 225.29 g/mol, XLogP of 3.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,4-tetrahydroquinolin-5-yl)phenol is sourced from PubChem (CID 69017976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).