6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline

C20H18N2O2 — CID 11347703

IUPAC6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline
SMILESCOc1ccc(OC)c2c1nc(C)c1ccn(-c3ccccc3)c12
InChIInChI=1S/C20H18N2O2/c1-13-15-11-12-22(14-7-5-4-6-8-14)20(15)18-16(23-2)9-10-17(24-3)19(18)21-13/h4-12H,1-3H3
InChIKeyFTYRMCBPROPKKY-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.50
Rot. Bonds3

About 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline

6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline (PubChem CID 11347703) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline.

Molecular Properties

Compound Name6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline
PubChem CID11347703
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline
SMILESCOc1ccc(OC)c2c1nc(C)c1ccn(-c3ccccc3)c12
InChIInChI=1S/C20H18N2O2/c1-13-15-11-12-22(14-7-5-4-6-8-14)20(15)18-16(23-2)9-10-17(24-3)19(18)21-13/h4-12H,1-3H3
InChIKeyFTYRMCBPROPKKY-UHFFFAOYSA-N
XLogP4.50
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline?
The IUPAC name of 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline (CID 11347703) is 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline.
What is the SMILES notation for 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline?
The canonical SMILES for 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline is COc1ccc(OC)c2c1nc(C)c1ccn(-c3ccccc3)c12.
What is the InChIKey of 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline?
The InChIKey is FTYRMCBPROPKKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-13-15-11-12-22(14-7-5-4-6-8-14)20(15)18-16(23-2)9-10-17(24-3)19(18)21-13/h4-12H,1-3H3.
What are the key properties of 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline?
6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline has a molecular weight of 318.38 g/mol, XLogP of 4.50, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,9-dimethoxy-4-methyl-1-phenylpyrrolo[3,2-c]quinoline is sourced from PubChem (CID 11347703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).