3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide

C24H23N3O2 — CID 25328995

IUPAC3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide
SMILESCOc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2ncccc2C)cc1
InChIInChI=1S/C24H23N3O2/c1-16-6-5-15-25-24(16)27-22(28)14-13-20-19-7-3-4-8-21(19)26-23(20)17-9-11-18(29-2)12-10-17/h3-12,15,26H,13-14H2,1-2H3,(H,25,27,28)
InChIKeyFEZHBNGVOXRZNI-UHFFFAOYSA-N
MW385.47 g/mol
LogP5.12
Rot. Bonds6

About 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide

3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide (PubChem CID 25328995) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide
PubChem CID25328995
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC Name3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide
SMILESCOc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2ncccc2C)cc1
InChIInChI=1S/C24H23N3O2/c1-16-6-5-15-25-24(16)27-22(28)14-13-20-19-7-3-4-8-21(19)26-23(20)17-9-11-18(29-2)12-10-17/h3-12,15,26H,13-14H2,1-2H3,(H,25,27,28)
InChIKeyFEZHBNGVOXRZNI-UHFFFAOYSA-N
XLogP5.12
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.47
LogP ≤ 55.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide?
The IUPAC name of 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide (CID 25328995) is 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide?
The canonical SMILES for 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide is COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2ncccc2C)cc1.
What is the InChIKey of 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide?
The InChIKey is FEZHBNGVOXRZNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-16-6-5-15-25-24(16)27-22(28)14-13-20-19-7-3-4-8-21(19)26-23(20)17-9-11-18(29-2)12-10-17/h3-12,15,26H,13-14H2,1-2H3,(H,25,27,28).
What are the key properties of 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide?
3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide has a molecular weight of 385.47 g/mol, XLogP of 5.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 25328995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).