3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide

C15H13N3O2 — CID 66667151

IUPAC3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide
SMILESCNC(=O)c1ccc2c(C(N)=O)c3ccccn3c2c1
InChIInChI=1S/C15H13N3O2/c1-17-15(20)9-5-6-10-12(8-9)18-7-3-2-4-11(18)13(10)14(16)19/h2-8H,1H3,(H2,16,19)(H,17,20)
InChIKeyJMUYHNFCGSGFDJ-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.55
Rot. Bonds2

About 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide

3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide (PubChem CID 66667151) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide.

Molecular Properties

Compound Name3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide
PubChem CID66667151
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide
SMILESCNC(=O)c1ccc2c(C(N)=O)c3ccccn3c2c1
InChIInChI=1S/C15H13N3O2/c1-17-15(20)9-5-6-10-12(8-9)18-7-3-2-4-11(18)13(10)14(16)19/h2-8H,1H3,(H2,16,19)(H,17,20)
InChIKeyJMUYHNFCGSGFDJ-UHFFFAOYSA-N
XLogP1.55
TPSA76.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide 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 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide?
The IUPAC name of 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide (CID 66667151) is 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide.
What is the SMILES notation for 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide?
The canonical SMILES for 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide is CNC(=O)c1ccc2c(C(N)=O)c3ccccn3c2c1.
What is the InChIKey of 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide?
The InChIKey is JMUYHNFCGSGFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-17-15(20)9-5-6-10-12(8-9)18-7-3-2-4-11(18)13(10)14(16)19/h2-8H,1H3,(H2,16,19)(H,17,20).
What are the key properties of 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide?
3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide has a molecular weight of 267.29 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide is sourced from PubChem (CID 66667151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).