6-methylpyrrolo[1,2-a]indol-4-one

C12H9NO — CID 19956225

IUPAC6-methylpyrrolo[1,2-a]indol-4-one
SMILESCc1ccc2c(c1)C(=O)c1cccn1-2
InChIInChI=1S/C12H9NO/c1-8-4-5-10-9(7-8)12(14)11-3-2-6-13(10)11/h2-7H,1H3
InChIKeyQIDZJMFPLITNSU-UHFFFAOYSA-N
MW183.21 g/mol
LogP2.33
Rot. Bonds

About 6-methylpyrrolo[1,2-a]indol-4-one

6-methylpyrrolo[1,2-a]indol-4-one (PubChem CID 19956225) has the molecular formula C12H9NO and a molecular weight of 183.21 g/mol. Its IUPAC name is 6-methylpyrrolo[1,2-a]indol-4-one.

Molecular Properties

Compound Name6-methylpyrrolo[1,2-a]indol-4-one
PubChem CID19956225
Molecular FormulaC12H9NO
Molecular Weight183.21 g/mol
Exact Mass183.07
IUPAC Name6-methylpyrrolo[1,2-a]indol-4-one
SMILESCc1ccc2c(c1)C(=O)c1cccn1-2
InChIInChI=1S/C12H9NO/c1-8-4-5-10-9(7-8)12(14)11-3-2-6-13(10)11/h2-7H,1H3
InChIKeyQIDZJMFPLITNSU-UHFFFAOYSA-N
XLogP2.33
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methylpyrrolo[1,2-a]indol-4-one?
The IUPAC name of 6-methylpyrrolo[1,2-a]indol-4-one (CID 19956225) is 6-methylpyrrolo[1,2-a]indol-4-one.
What is the SMILES notation for 6-methylpyrrolo[1,2-a]indol-4-one?
The canonical SMILES for 6-methylpyrrolo[1,2-a]indol-4-one is Cc1ccc2c(c1)C(=O)c1cccn1-2.
What is the InChIKey of 6-methylpyrrolo[1,2-a]indol-4-one?
The InChIKey is QIDZJMFPLITNSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO/c1-8-4-5-10-9(7-8)12(14)11-3-2-6-13(10)11/h2-7H,1H3.
What are the key properties of 6-methylpyrrolo[1,2-a]indol-4-one?
6-methylpyrrolo[1,2-a]indol-4-one has a molecular weight of 183.21 g/mol, XLogP of 2.33, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylpyrrolo[1,2-a]indol-4-one is sourced from PubChem (CID 19956225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).