5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol

C18H18N2O — CID 3044192

IUPAC5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol
SMILESCc1ccc(C2(O)Cc3ccccc3C3=NCCN32)cc1
InChIInChI=1S/C18H18N2O/c1-13-6-8-15(9-7-13)18(21)12-14-4-2-3-5-16(14)17-19-10-11-20(17)18/h2-9,21H,10-12H2,1H3
InChIKeyFWCVCAUHZGOSNT-UHFFFAOYSA-N
MW278.36 g/mol
LogP2.46
Rot. Bonds1

About 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol

5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol (PubChem CID 3044192) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol.

Molecular Properties

Compound Name5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol
PubChem CID3044192
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol
SMILESCc1ccc(C2(O)Cc3ccccc3C3=NCCN32)cc1
InChIInChI=1S/C18H18N2O/c1-13-6-8-15(9-7-13)18(21)12-14-4-2-3-5-16(14)17-19-10-11-20(17)18/h2-9,21H,10-12H2,1H3
InChIKeyFWCVCAUHZGOSNT-UHFFFAOYSA-N
XLogP2.46
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol?
The IUPAC name of 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol (CID 3044192) is 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol.
What is the SMILES notation for 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol?
The canonical SMILES for 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol is Cc1ccc(C2(O)Cc3ccccc3C3=NCCN32)cc1.
What is the InChIKey of 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol?
The InChIKey is FWCVCAUHZGOSNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-6-8-15(9-7-13)18(21)12-14-4-2-3-5-16(14)17-19-10-11-20(17)18/h2-9,21H,10-12H2,1H3.
What are the key properties of 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol?
5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol has a molecular weight of 278.36 g/mol, XLogP of 2.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol is sourced from PubChem (CID 3044192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).