1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide

C23H18N4O2 — CID 6622464

IUPAC1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide
SMILESCn1c(C(=O)Nc2cnc3ccccc3c2)cc2c(=O)n(C)c3ccccc3c21
InChIInChI=1S/C23H18N4O2/c1-26-20(22(28)25-15-11-14-7-3-5-9-18(14)24-13-15)12-17-21(26)16-8-4-6-10-19(16)27(2)23(17)29/h3-13H,1-2H3,(H,25,28)
InChIKeyXDWVXZBZSWGHNT-UHFFFAOYSA-N
MW382.42 g/mol
LogP3.83
Rot. Bonds2

About 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide

1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide (PubChem CID 6622464) has the molecular formula C23H18N4O2 and a molecular weight of 382.42 g/mol. Its IUPAC name is 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide
PubChem CID6622464
Molecular FormulaC23H18N4O2
Molecular Weight382.42 g/mol
Exact Mass382.14
IUPAC Name1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide
SMILESCn1c(C(=O)Nc2cnc3ccccc3c2)cc2c(=O)n(C)c3ccccc3c21
InChIInChI=1S/C23H18N4O2/c1-26-20(22(28)25-15-11-14-7-3-5-9-18(14)24-13-15)12-17-21(26)16-8-4-6-10-19(16)27(2)23(17)29/h3-13H,1-2H3,(H,25,28)
InChIKeyXDWVXZBZSWGHNT-UHFFFAOYSA-N
XLogP3.83
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide?
The IUPAC name of 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide (CID 6622464) is 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide is Cn1c(C(=O)Nc2cnc3ccccc3c2)cc2c(=O)n(C)c3ccccc3c21.
What is the InChIKey of 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide?
The InChIKey is XDWVXZBZSWGHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O2/c1-26-20(22(28)25-15-11-14-7-3-5-9-18(14)24-13-15)12-17-21(26)16-8-4-6-10-19(16)27(2)23(17)29/h3-13H,1-2H3,(H,25,28).
What are the key properties of 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide?
1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide has a molecular weight of 382.42 g/mol, XLogP of 3.83, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-4-oxo-N-quinolin-3-ylpyrrolo[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 6622464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).