1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one

C16H13N3O2 — CID 142822180

IUPAC1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one
SMILESCOc1ccc2[nH]c3cc(C)c4c(c3c2c1)C(N)=NC4=O
InChIInChI=1S/C16H13N3O2/c1-7-5-11-13(14-12(7)16(20)19-15(14)17)9-6-8(21-2)3-4-10(9)18-11/h3-6,18H,1-2H3,(H2,17,19,20)
InChIKeyOUEFCSQKQQMAHJ-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.50
Rot. Bonds1

About 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one

1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one (PubChem CID 142822180) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one.

Molecular Properties

Compound Name1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one
PubChem CID142822180
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one
SMILESCOc1ccc2[nH]c3cc(C)c4c(c3c2c1)C(N)=NC4=O
InChIInChI=1S/C16H13N3O2/c1-7-5-11-13(14-12(7)16(20)19-15(14)17)9-6-8(21-2)3-4-10(9)18-11/h3-6,18H,1-2H3,(H2,17,19,20)
InChIKeyOUEFCSQKQQMAHJ-UHFFFAOYSA-N
XLogP2.50
TPSA80.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one?
The IUPAC name of 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one (CID 142822180) is 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one.
What is the SMILES notation for 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one?
The canonical SMILES for 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one is COc1ccc2[nH]c3cc(C)c4c(c3c2c1)C(N)=NC4=O.
What is the InChIKey of 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one?
The InChIKey is OUEFCSQKQQMAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-7-5-11-13(14-12(7)16(20)19-15(14)17)9-6-8(21-2)3-4-10(9)18-11/h3-6,18H,1-2H3,(H2,17,19,20).
What are the key properties of 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one?
1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one has a molecular weight of 279.30 g/mol, XLogP of 2.50, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-9-methoxy-4-methyl-6H-pyrrolo[3,4-c]carbazol-3-one is sourced from PubChem (CID 142822180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).