2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide

C16H15N3O — CID 63671729

IUPAC2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide
SMILESCc1cnccc1NC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C16H15N3O/c1-11-9-17-7-6-14(11)19-16(20)8-12-10-18-15-5-3-2-4-13(12)15/h2-7,9-10,18H,8H2,1H3,(H,17,19,20)
InChIKeyXGAJMINACAEONF-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.05
Rot. Bonds3

About 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide

2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide (PubChem CID 63671729) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide
PubChem CID63671729
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide
SMILESCc1cnccc1NC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C16H15N3O/c1-11-9-17-7-6-14(11)19-16(20)8-12-10-18-15-5-3-2-4-13(12)15/h2-7,9-10,18H,8H2,1H3,(H,17,19,20)
InChIKeyXGAJMINACAEONF-UHFFFAOYSA-N
XLogP3.05
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide (CID 63671729) is 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide is Cc1cnccc1NC(=O)Cc1c[nH]c2ccccc12.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide?
The InChIKey is XGAJMINACAEONF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11-9-17-7-6-14(11)19-16(20)8-12-10-18-15-5-3-2-4-13(12)15/h2-7,9-10,18H,8H2,1H3,(H,17,19,20).
What are the key properties of 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide?
2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide has a molecular weight of 265.32 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide is sourced from PubChem (CID 63671729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).