6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline

C14H16N2O2 — CID 84631224

IUPAC6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
SMILESCOc1cc(OC)c2nc3c(cc2c1)CC(C)N3
InChIInChI=1S/C14H16N2O2/c1-8-4-10-5-9-6-11(17-2)7-12(18-3)13(9)16-14(10)15-8/h5-8H,4H2,1-3H3,(H,15,16)
InChIKeyHMAFGXQFXIWPMA-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.61
Rot. Bonds2

About 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline

6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline (PubChem CID 84631224) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline.

Molecular Properties

Compound Name6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
PubChem CID84631224
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
SMILESCOc1cc(OC)c2nc3c(cc2c1)CC(C)N3
InChIInChI=1S/C14H16N2O2/c1-8-4-10-5-9-6-11(17-2)7-12(18-3)13(9)16-14(10)15-8/h5-8H,4H2,1-3H3,(H,15,16)
InChIKeyHMAFGXQFXIWPMA-UHFFFAOYSA-N
XLogP2.61
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline?
The IUPAC name of 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline (CID 84631224) is 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline.
What is the SMILES notation for 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline?
The canonical SMILES for 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline is COc1cc(OC)c2nc3c(cc2c1)CC(C)N3.
What is the InChIKey of 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline?
The InChIKey is HMAFGXQFXIWPMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-8-4-10-5-9-6-11(17-2)7-12(18-3)13(9)16-14(10)15-8/h5-8H,4H2,1-3H3,(H,15,16).
What are the key properties of 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline?
6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline has a molecular weight of 244.29 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethoxy-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline is sourced from PubChem (CID 84631224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).