4-(2,3-dihydroindol-1-yl)-2-phenylquinoline

C23H18N2 — CID 91742521

IUPAC4-(2,3-dihydroindol-1-yl)-2-phenylquinoline
SMILESc1ccc(-c2cc(N3CCc4ccccc43)c3ccccc3n2)cc1
InChIInChI=1S/C23H18N2/c1-2-8-17(9-3-1)21-16-23(19-11-5-6-12-20(19)24-21)25-15-14-18-10-4-7-13-22(18)25/h1-13,16H,14-15H2
InChIKeyRKMCJIMPEKJODX-UHFFFAOYSA-N
MW322.41 g/mol
LogP5.60
Rot. Bonds2

About 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline

4-(2,3-dihydroindol-1-yl)-2-phenylquinoline (PubChem CID 91742521) has the molecular formula C23H18N2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline.

Molecular Properties

Compound Name4-(2,3-dihydroindol-1-yl)-2-phenylquinoline
PubChem CID91742521
Molecular FormulaC23H18N2
Molecular Weight322.41 g/mol
Exact Mass322.15
IUPAC Name4-(2,3-dihydroindol-1-yl)-2-phenylquinoline
SMILESc1ccc(-c2cc(N3CCc4ccccc43)c3ccccc3n2)cc1
InChIInChI=1S/C23H18N2/c1-2-8-17(9-3-1)21-16-23(19-11-5-6-12-20(19)24-21)25-15-14-18-10-4-7-13-22(18)25/h1-13,16H,14-15H2
InChIKeyRKMCJIMPEKJODX-UHFFFAOYSA-N
XLogP5.60
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.41
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline?
The IUPAC name of 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline (CID 91742521) is 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline.
What is the SMILES notation for 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline?
The canonical SMILES for 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline is c1ccc(-c2cc(N3CCc4ccccc43)c3ccccc3n2)cc1.
What is the InChIKey of 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline?
The InChIKey is RKMCJIMPEKJODX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2/c1-2-8-17(9-3-1)21-16-23(19-11-5-6-12-20(19)24-21)25-15-14-18-10-4-7-13-22(18)25/h1-13,16H,14-15H2.
What are the key properties of 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline?
4-(2,3-dihydroindol-1-yl)-2-phenylquinoline has a molecular weight of 322.41 g/mol, XLogP of 5.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydroindol-1-yl)-2-phenylquinoline is sourced from PubChem (CID 91742521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).