5-(4-phenylphenyl)-1H-indole-7-carboxamide

C21H16N2O — CID 11174416

IUPAC5-(4-phenylphenyl)-1H-indole-7-carboxamide
SMILESNC(=O)c1cc(-c2ccc(-c3ccccc3)cc2)cc2cc[nH]c12
InChIInChI=1S/C21H16N2O/c22-21(24)19-13-18(12-17-10-11-23-20(17)19)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-13,23H,(H2,22,24)
InChIKeyQABRODLIUOFBFN-UHFFFAOYSA-N
MW312.37 g/mol
LogP4.60
Rot. Bonds3

About 5-(4-phenylphenyl)-1H-indole-7-carboxamide

5-(4-phenylphenyl)-1H-indole-7-carboxamide (PubChem CID 11174416) has the molecular formula C21H16N2O and a molecular weight of 312.37 g/mol. Its IUPAC name is 5-(4-phenylphenyl)-1H-indole-7-carboxamide.

Molecular Properties

Compound Name5-(4-phenylphenyl)-1H-indole-7-carboxamide
PubChem CID11174416
Molecular FormulaC21H16N2O
Molecular Weight312.37 g/mol
Exact Mass312.13
IUPAC Name5-(4-phenylphenyl)-1H-indole-7-carboxamide
SMILESNC(=O)c1cc(-c2ccc(-c3ccccc3)cc2)cc2cc[nH]c12
InChIInChI=1S/C21H16N2O/c22-21(24)19-13-18(12-17-10-11-23-20(17)19)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-13,23H,(H2,22,24)
InChIKeyQABRODLIUOFBFN-UHFFFAOYSA-N
XLogP4.60
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(4-phenylphenyl)-1H-indole-7-carboxamide?
The IUPAC name of 5-(4-phenylphenyl)-1H-indole-7-carboxamide (CID 11174416) is 5-(4-phenylphenyl)-1H-indole-7-carboxamide.
What is the SMILES notation for 5-(4-phenylphenyl)-1H-indole-7-carboxamide?
The canonical SMILES for 5-(4-phenylphenyl)-1H-indole-7-carboxamide is NC(=O)c1cc(-c2ccc(-c3ccccc3)cc2)cc2cc[nH]c12.
What is the InChIKey of 5-(4-phenylphenyl)-1H-indole-7-carboxamide?
The InChIKey is QABRODLIUOFBFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O/c22-21(24)19-13-18(12-17-10-11-23-20(17)19)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-13,23H,(H2,22,24).
What are the key properties of 5-(4-phenylphenyl)-1H-indole-7-carboxamide?
5-(4-phenylphenyl)-1H-indole-7-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 4.60, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-phenylphenyl)-1H-indole-7-carboxamide is sourced from PubChem (CID 11174416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).