3-phenyl-1H-pyrrolo[3,4-g]indol-8-one

C16H10N2O — CID 133084135

IUPAC3-phenyl-1H-pyrrolo[3,4-g]indol-8-one
SMILESO=C1N=Cc2ccc3c(-c4ccccc4)c[nH]c3c21
InChIInChI=1S/C16H10N2O/c19-16-14-11(8-18-16)6-7-12-13(9-17-15(12)14)10-4-2-1-3-5-10/h1-9,17H
InChIKeyYJGNZVVUIPDSRL-UHFFFAOYSA-N
MW246.27 g/mol
LogP3.41
Rot. Bonds1

About 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one

3-phenyl-1H-pyrrolo[3,4-g]indol-8-one (PubChem CID 133084135) has the molecular formula C16H10N2O and a molecular weight of 246.27 g/mol. Its IUPAC name is 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one.

Molecular Properties

Compound Name3-phenyl-1H-pyrrolo[3,4-g]indol-8-one
PubChem CID133084135
Molecular FormulaC16H10N2O
Molecular Weight246.27 g/mol
Exact Mass246.08
IUPAC Name3-phenyl-1H-pyrrolo[3,4-g]indol-8-one
SMILESO=C1N=Cc2ccc3c(-c4ccccc4)c[nH]c3c21
InChIInChI=1S/C16H10N2O/c19-16-14-11(8-18-16)6-7-12-13(9-17-15(12)14)10-4-2-1-3-5-10/h1-9,17H
InChIKeyYJGNZVVUIPDSRL-UHFFFAOYSA-N
XLogP3.41
TPSA45.22 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 134859239
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CID 144569314
2-[(3-phenyl-1H-pyrrolo[2,3-c]pyridin-7-yl)amino]ethanol
CID 86179128
6-bromo-4-phenyl-2H-isoquinolin-1-one
CID 155046719
7-methyl-3-phenyl-1H-quinolin-4-one
CID 59110346
methane;3-phenyl-1H-indole
CID 167711687
3-phenyl-1H-chromeno[4,3-b]pyrrol-4-one
CID 15419530
3-anthracen-9-yl-1H-benzo[g]indole
CID 170135106
isoquinoline-3,4-dione
CID 57252466
3-pyridin-4-yl-1H-indole
CID 159430533
2,3-diiodo-8-phenyl-6H-imidazo[1,2-c]pyrimidin-5-one
CID 136817201
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CID 142621956

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one?
The IUPAC name of 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one (CID 133084135) is 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one.
What is the SMILES notation for 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one?
The canonical SMILES for 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one is O=C1N=Cc2ccc3c(-c4ccccc4)c[nH]c3c21.
What is the InChIKey of 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one?
The InChIKey is YJGNZVVUIPDSRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O/c19-16-14-11(8-18-16)6-7-12-13(9-17-15(12)14)10-4-2-1-3-5-10/h1-9,17H.
What are the key properties of 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one?
3-phenyl-1H-pyrrolo[3,4-g]indol-8-one has a molecular weight of 246.27 g/mol, XLogP of 3.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1H-pyrrolo[3,4-g]indol-8-one is sourced from PubChem (CID 133084135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).