1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol

C18H16N2O — CID 4000176

IUPAC1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol
SMILESOc1ccc2c(c1)CCNC2c1ccc2ccccc2n1
InChIInChI=1S/C18H16N2O/c21-14-6-7-15-13(11-14)9-10-19-18(15)17-8-5-12-3-1-2-4-16(12)20-17/h1-8,11,18-19,21H,9-10H2
InChIKeyKEFKNYHTNKCUSC-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.18
Rot. Bonds1

About 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol

1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol (PubChem CID 4000176) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol.

Molecular Properties

Compound Name1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol
PubChem CID4000176
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC Name1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol
SMILESOc1ccc2c(c1)CCNC2c1ccc2ccccc2n1
InChIInChI=1S/C18H16N2O/c21-14-6-7-15-13(11-14)9-10-19-18(15)17-8-5-12-3-1-2-4-16(12)20-17/h1-8,11,18-19,21H,9-10H2
InChIKeyKEFKNYHTNKCUSC-UHFFFAOYSA-N
XLogP3.18
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol with MolForge

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Related Compounds

Tan-67
CID 9950038
(1S,14R,15R)-25-(cyclopropylmethyl)-4,25-diazahexacyclo[13.7.3.01,14.03,12.05,10.017,22]pentacosa-3,5,7,9,11,17(22),18,20-octaen-20-ol
CID 23642304
(1S,14R,15R)-25-methyl-4,25-diazahexacyclo[13.7.3.01,14.03,12.05,10.017,22]pentacosa-3,5,7,9,11,17(22),18,20-octaen-20-ol
CID 44467662
(1S,14R,15R)-25-(2-methylpropyl)-4,25-diazahexacyclo[13.7.3.01,14.03,12.05,10.017,22]pentacosa-3,5,7,9,11,17(22),18,20-octaen-20-ol
CID 45270599
3-[(4Ar,12aS)-2-methyl-1,3,4,5,12,12a-hexahydropyrido[3,4-b]acridin-4a-yl]phenol
CID 9911115
2-(4-Hydroxyphenyl)-4-vinylquinolin-6-ol
CID 135409729
4-Ethyl-2-(4-hydroxyphenyl)quinolin-6-ol
CID 135430317
4-Ethynyl-2-(4-hydroxyphenyl)quinolin-6-ol
CID 135524856
2-(4-Hydroxy-phenyl)-quinolin-6-ol
CID 135987619
5-(Anilinomethyl)quinolin-8-ol
CID 644901
5-((1,2,3,4-Tetrahydroisoquinolin-2-yl)methyl)quinolin-8-ol
CID 2398303
5-[(4-Benzylpiperidin-1-yl)methyl]quinolin-8-ol
CID 698133

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol?
The IUPAC name of 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol (CID 4000176) is 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol.
What is the SMILES notation for 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol?
The canonical SMILES for 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol is Oc1ccc2c(c1)CCNC2c1ccc2ccccc2n1.
What is the InChIKey of 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol?
The InChIKey is KEFKNYHTNKCUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c21-14-6-7-15-13(11-14)9-10-19-18(15)17-8-5-12-3-1-2-4-16(12)20-17/h1-8,11,18-19,21H,9-10H2.
What are the key properties of 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol?
1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol has a molecular weight of 276.34 g/mol, XLogP of 3.18, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol is sourced from PubChem (CID 4000176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).