2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide

C21H17N3O — CID 117089782

IUPAC2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide
SMILESCn1ccc2cc(-c3cc(C(=O)Nc4ccccc4)ccn3)ccc21
InChIInChI=1S/C21H17N3O/c1-24-12-10-16-13-15(7-8-20(16)24)19-14-17(9-11-22-19)21(25)23-18-5-3-2-4-6-18/h2-14H,1H3,(H,23,25)
InChIKeyMOMOYWGLFIQFEG-UHFFFAOYSA-N
MW327.39 g/mol
LogP4.49
Rot. Bonds3

About 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide

2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide (PubChem CID 117089782) has the molecular formula C21H17N3O and a molecular weight of 327.39 g/mol. Its IUPAC name is 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide
PubChem CID117089782
Molecular FormulaC21H17N3O
Molecular Weight327.39 g/mol
Exact Mass327.14
IUPAC Name2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide
SMILESCn1ccc2cc(-c3cc(C(=O)Nc4ccccc4)ccn3)ccc21
InChIInChI=1S/C21H17N3O/c1-24-12-10-16-13-15(7-8-20(16)24)19-14-17(9-11-22-19)21(25)23-18-5-3-2-4-6-18/h2-14H,1H3,(H,23,25)
InChIKeyMOMOYWGLFIQFEG-UHFFFAOYSA-N
XLogP4.49
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide?
The IUPAC name of 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide (CID 117089782) is 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide.
What is the SMILES notation for 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide?
The canonical SMILES for 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide is Cn1ccc2cc(-c3cc(C(=O)Nc4ccccc4)ccn3)ccc21.
What is the InChIKey of 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide?
The InChIKey is MOMOYWGLFIQFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O/c1-24-12-10-16-13-15(7-8-20(16)24)19-14-17(9-11-22-19)21(25)23-18-5-3-2-4-6-18/h2-14H,1H3,(H,23,25).
What are the key properties of 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide?
2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide has a molecular weight of 327.39 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindol-5-yl)-N-phenylpyridine-4-carboxamide is sourced from PubChem (CID 117089782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).