6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one

C14H10Cl2N2O — CID 76847484

IUPAC6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one
SMILESCc1nc(-c2ccc(Cl)cc2Cl)cc2c1CNC2=O
InChIInChI=1S/C14H10Cl2N2O/c1-7-11-6-17-14(19)10(11)5-13(18-7)9-3-2-8(15)4-12(9)16/h2-5H,6H2,1H3,(H,17,19)
InChIKeyQQNBVEGRSIPXLX-UHFFFAOYSA-N
MW293.15 g/mol
LogP3.61
Rot. Bonds1

About 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one

6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one (PubChem CID 76847484) has the molecular formula C14H10Cl2N2O and a molecular weight of 293.15 g/mol. Its IUPAC name is 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one.

Molecular Properties

Compound Name6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one
PubChem CID76847484
Molecular FormulaC14H10Cl2N2O
Molecular Weight293.15 g/mol
Exact Mass292.02
IUPAC Name6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one
SMILESCc1nc(-c2ccc(Cl)cc2Cl)cc2c1CNC2=O
InChIInChI=1S/C14H10Cl2N2O/c1-7-11-6-17-14(19)10(11)5-13(18-7)9-3-2-8(15)4-12(9)16/h2-5H,6H2,1H3,(H,17,19)
InChIKeyQQNBVEGRSIPXLX-UHFFFAOYSA-N
XLogP3.61
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.15
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(aminomethyl)-4-(2,4-dichlorophenyl)-2-methyl-5,6-dihydropyrrolo[3,4-b]pyridin-7-one
CID 15950456
6-chloro-4-fluoro-2,3-dihydroisoindol-1-one
CID 130064719
2,4,6-tris(2,4-dichlorophenyl)pyridine
CID 86059634
4-chloro-5-fluoro-2,3-dihydroisoindol-1-one
CID 130064723
bis(5-chloro-2,3-dihydroisoindol-1-one);1,3-xylene
CID 67160058
2,6-bis(2,4-dichlorophenyl)pyridin-4-amine
CID 133087176
3-(2,4-dichlorophenyl)-1H-pyridazin-6-one
CID 43583824
2-(2,4-dichlorophenyl)-4-(iodomethyl)-5,6-dimethylpyrimidine
CID 89358004
3-(2,4-dichlorophenyl)-5-ethyl-1H-1,2,4-triazole
CID 61278120
5-(2,4-dichlorophenyl)-3-ethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 22308919
3-[6-(2,4-dichlorophenyl)-2-methyl-3-pyridinyl]propanoic acid
CID 82452786
2-(2,4-dichlorophenyl)-1,4,5-trimethylimidazole
CID 102416631

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one?
The IUPAC name of 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one (CID 76847484) is 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one.
What is the SMILES notation for 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one?
The canonical SMILES for 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one is Cc1nc(-c2ccc(Cl)cc2Cl)cc2c1CNC2=O.
What is the InChIKey of 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one?
The InChIKey is QQNBVEGRSIPXLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2O/c1-7-11-6-17-14(19)10(11)5-13(18-7)9-3-2-8(15)4-12(9)16/h2-5H,6H2,1H3,(H,17,19).
What are the key properties of 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one?
6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one has a molecular weight of 293.15 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dichlorophenyl)-4-methyl-2,3-dihydropyrrolo[3,4-c]pyridin-1-one is sourced from PubChem (CID 76847484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).