6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline

C13H12N2 — CID 135523687

IUPAC6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline
SMILESCc1cc(C)c2ccc3ccnc3c2[nH]1
InChIInChI=1S/C13H12N2/c1-8-7-9(2)15-13-11(8)4-3-10-5-6-14-12(10)13/h3-7,15H,1-2H3
InChIKeyMLMAPLRXMVGQDO-UHFFFAOYSA-N
MW196.25 g/mol
LogP3.33
Rot. Bonds

About 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline

6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline (PubChem CID 135523687) has the molecular formula C13H12N2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline.

Molecular Properties

Compound Name6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline
PubChem CID135523687
Molecular FormulaC13H12N2
Molecular Weight196.25 g/mol
Exact Mass196.10
IUPAC Name6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline
SMILESCc1cc(C)c2ccc3ccnc3c2[nH]1
InChIInChI=1S/C13H12N2/c1-8-7-9(2)15-13-11(8)4-3-10-5-6-14-12(10)13/h3-7,15H,1-2H3
InChIKeyMLMAPLRXMVGQDO-UHFFFAOYSA-N
XLogP3.33
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline?
The IUPAC name of 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline (CID 135523687) is 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline.
What is the SMILES notation for 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline?
The canonical SMILES for 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline is Cc1cc(C)c2ccc3ccnc3c2[nH]1.
What is the InChIKey of 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline?
The InChIKey is MLMAPLRXMVGQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2/c1-8-7-9(2)15-13-11(8)4-3-10-5-6-14-12(10)13/h3-7,15H,1-2H3.
What are the key properties of 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline?
6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline has a molecular weight of 196.25 g/mol, XLogP of 3.33, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline is sourced from PubChem (CID 135523687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).