9-(4-methoxyisoquinolin-1-yl)carbazole

C22H16N2O — CID 153491073

IUPAC9-(4-methoxyisoquinolin-1-yl)carbazole
SMILESCOc1cnc(-n2c3ccccc3c3ccccc32)c2ccccc12
InChIInChI=1S/C22H16N2O/c1-25-21-14-23-22(18-11-3-2-10-17(18)21)24-19-12-6-4-8-15(19)16-9-5-7-13-20(16)24/h2-14H,1H3
InChIKeyAWSFIRRJELLSAU-UHFFFAOYSA-N
MW324.38 g/mol
LogP5.34
Rot. Bonds2

About 9-(4-methoxyisoquinolin-1-yl)carbazole

9-(4-methoxyisoquinolin-1-yl)carbazole (PubChem CID 153491073) has the molecular formula C22H16N2O and a molecular weight of 324.38 g/mol. Its IUPAC name is 9-(4-methoxyisoquinolin-1-yl)carbazole.

Molecular Properties

Compound Name9-(4-methoxyisoquinolin-1-yl)carbazole
PubChem CID153491073
Molecular FormulaC22H16N2O
Molecular Weight324.38 g/mol
Exact Mass324.13
IUPAC Name9-(4-methoxyisoquinolin-1-yl)carbazole
SMILESCOc1cnc(-n2c3ccccc3c3ccccc32)c2ccccc12
InChIInChI=1S/C22H16N2O/c1-25-21-14-23-22(18-11-3-2-10-17(18)21)24-19-12-6-4-8-15(19)16-9-5-7-13-20(16)24/h2-14H,1H3
InChIKeyAWSFIRRJELLSAU-UHFFFAOYSA-N
XLogP5.34
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.38
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-(2,6-dimethoxyphenyl)carbazole
CID 58050238
1-fluoro-4-methoxyisoquinoline
CID 70979100
9-(4-methoxy-3-methylphenyl)carbazole
CID 123263488
ethane;9-(5-fluoro-2-methoxyphenyl)carbazole
CID 144565346
(2-carbazol-9-yl-6-methoxyphenyl)-methyl-phosphanylphosphane
CID 129309761
10-(2-methoxyphenyl)-1-azatricyclo[6.1.1.02,7]deca-2,4,6,8(10)-tetraen-9-one
CID 67595885
(2-carbazol-9-yl-6-methoxyphenyl)-methylphosphane
CID 129309635
4-methoxy-2-methyl-1-pyridin-2-ylindole
CID 170694384
(2-carbazol-9-yl-6-methoxyphenyl)-diphenylphosphane
CID 118467175
9-quinazolin-4-yl-3-(9-quinazolin-4-ylcarbazol-3-yl)carbazole
CID 166905672
9-[2,5,6-tri(carbazol-9-yl)-3-pyridinyl]carbazole
CID 122400298
9-(4-methoxy-3-phenoxyphenyl)carbazole
CID 163549151

Frequently Asked Questions

What is the IUPAC name of 9-(4-methoxyisoquinolin-1-yl)carbazole?
The IUPAC name of 9-(4-methoxyisoquinolin-1-yl)carbazole (CID 153491073) is 9-(4-methoxyisoquinolin-1-yl)carbazole.
What is the SMILES notation for 9-(4-methoxyisoquinolin-1-yl)carbazole?
The canonical SMILES for 9-(4-methoxyisoquinolin-1-yl)carbazole is COc1cnc(-n2c3ccccc3c3ccccc32)c2ccccc12.
What is the InChIKey of 9-(4-methoxyisoquinolin-1-yl)carbazole?
The InChIKey is AWSFIRRJELLSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O/c1-25-21-14-23-22(18-11-3-2-10-17(18)21)24-19-12-6-4-8-15(19)16-9-5-7-13-20(16)24/h2-14H,1H3.
What are the key properties of 9-(4-methoxyisoquinolin-1-yl)carbazole?
9-(4-methoxyisoquinolin-1-yl)carbazole has a molecular weight of 324.38 g/mol, XLogP of 5.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-methoxyisoquinolin-1-yl)carbazole is sourced from PubChem (CID 153491073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).