2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide

C17H17N3O — CID 31903883

IUPAC2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1cccc(NC(=O)Cc2c(C)[nH]c3ccccc23)n1
InChIInChI=1S/C17H17N3O/c1-11-6-5-9-16(18-11)20-17(21)10-14-12(2)19-15-8-4-3-7-13(14)15/h3-9,19H,10H2,1-2H3,(H,18,20,21)
InChIKeyNCQBMCSXXHPELI-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.36
Rot. Bonds3

About 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide

2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide (PubChem CID 31903883) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide
PubChem CID31903883
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1cccc(NC(=O)Cc2c(C)[nH]c3ccccc23)n1
InChIInChI=1S/C17H17N3O/c1-11-6-5-9-16(18-11)20-17(21)10-14-12(2)19-15-8-4-3-7-13(14)15/h3-9,19H,10H2,1-2H3,(H,18,20,21)
InChIKeyNCQBMCSXXHPELI-UHFFFAOYSA-N
XLogP3.36
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyphenyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31984043
N-(3-chlorophenyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31856117
N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 115680666
2-(2-methyl-1H-indol-3-yl)-N-(1-methyl-4-phenylpyrazol-5-yl)acetamide
CID 155909077
2-(2-methyl-1H-indol-3-yl)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide
CID 86979349
3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(6-methyl-2-pyridinyl)propanamide
CID 35505630
2-(2-methyl-1H-indol-3-yl)-N-(2,3,4-trifluorophenyl)acetamide
CID 113211384
2-(2-methyl-1H-indol-3-yl)-N-[2-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 60555655
2-(2-methyl-1H-indol-3-yl)-N-(5-nitro-1,3-thiazol-2-yl)acetamide
CID 23658504
2-(2-methyl-1H-indol-3-yl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]acetamide
CID 31986763
2-(2-methyl-1H-indol-3-yl)-N-(2-methylprop-2-enyl)acetamide
CID 114619029
2-(2-methyl-1H-indol-3-yl)-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]acetamide
CID 137200070

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide (CID 31903883) is 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide is Cc1cccc(NC(=O)Cc2c(C)[nH]c3ccccc23)n1.
What is the InChIKey of 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide?
The InChIKey is NCQBMCSXXHPELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-11-6-5-9-16(18-11)20-17(21)10-14-12(2)19-15-8-4-3-7-13(14)15/h3-9,19H,10H2,1-2H3,(H,18,20,21).
What are the key properties of 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide?
2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide has a molecular weight of 279.34 g/mol, XLogP of 3.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 31903883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).