1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide

C17H17N3O2 — CID 53014628

IUPAC1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide
SMILESCNC(=O)N1CCc2ccc(C(=O)Nc3ccccc3)cc21
InChIInChI=1S/C17H17N3O2/c1-18-17(22)20-10-9-12-7-8-13(11-15(12)20)16(21)19-14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3,(H,18,22)(H,19,21)
InChIKeyHCGNUROAQOODEA-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.64
Rot. Bonds2

About 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide

1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide (PubChem CID 53014628) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide.

Molecular Properties

Compound Name1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide
PubChem CID53014628
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide
SMILESCNC(=O)N1CCc2ccc(C(=O)Nc3ccccc3)cc21
InChIInChI=1S/C17H17N3O2/c1-18-17(22)20-10-9-12-7-8-13(11-15(12)20)16(21)19-14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3,(H,18,22)(H,19,21)
InChIKeyHCGNUROAQOODEA-UHFFFAOYSA-N
XLogP2.64
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide?
The IUPAC name of 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide (CID 53014628) is 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide.
What is the SMILES notation for 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide?
The canonical SMILES for 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide is CNC(=O)N1CCc2ccc(C(=O)Nc3ccccc3)cc21.
What is the InChIKey of 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide?
The InChIKey is HCGNUROAQOODEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-18-17(22)20-10-9-12-7-8-13(11-15(12)20)16(21)19-14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3,(H,18,22)(H,19,21).
What are the key properties of 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide?
1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide has a molecular weight of 295.34 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-methyl-6-N-phenyl-2,3-dihydroindole-1,6-dicarboxamide is sourced from PubChem (CID 53014628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).