2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide

C15H20N2O3 — CID 83173338

IUPAC2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide
SMILESCOCCCNC(=O)Cn1ccc2c(OC)cccc21
InChIInChI=1S/C15H20N2O3/c1-19-10-4-8-16-15(18)11-17-9-7-12-13(17)5-3-6-14(12)20-2/h3,5-7,9H,4,8,10-11H2,1-2H3,(H,16,18)
InChIKeyHHHXFCLFRVHQBR-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.80
Rot. Bonds7

About 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide

2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide (PubChem CID 83173338) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide
PubChem CID83173338
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide
SMILESCOCCCNC(=O)Cn1ccc2c(OC)cccc21
InChIInChI=1S/C15H20N2O3/c1-19-10-4-8-16-15(18)11-17-9-7-12-13(17)5-3-6-14(12)20-2/h3,5-7,9H,4,8,10-11H2,1-2H3,(H,16,18)
InChIKeyHHHXFCLFRVHQBR-UHFFFAOYSA-N
XLogP1.80
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-2-(4-propan-2-yloxyindol-1-yl)acetamide
CID 83165472
2-(4-methoxyindol-1-yl)-N-pentan-2-ylacetamide
CID 83174347
2-[4-(methanesulfonamido)indol-1-yl]-N-(2-methoxyethyl)acetamide
CID 86206980
2-(5-fluoroindol-1-yl)-N-(3-methoxypropyl)acetamide
CID 63850800
2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide
CID 112978341
N-(2-methoxyethyl)-2-(7-methoxyindol-1-yl)acetamide
CID 39315359
N-[2-(4-methoxyindol-1-yl)ethyl]-2-(1-methylindol-3-yl)acetamide
CID 91638636
2-(4-ethoxyindol-1-yl)-N-ethylacetamide
CID 83173518
ethyl 2-(4-methoxyindol-1-yl)acetate
CID 83162389
N-(3-methoxypropyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 46418575
N-(3-methoxypropyl)-2-[5-(methylaminomethyl)indol-1-yl]acetamide
CID 102915716
methyl 4-(4-methoxyindol-1-yl)butanoate
CID 83163082

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide?
The IUPAC name of 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide (CID 83173338) is 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide.
What is the SMILES notation for 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide?
The canonical SMILES for 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide is COCCCNC(=O)Cn1ccc2c(OC)cccc21.
What is the InChIKey of 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide?
The InChIKey is HHHXFCLFRVHQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-19-10-4-8-16-15(18)11-17-9-7-12-13(17)5-3-6-14(12)20-2/h3,5-7,9H,4,8,10-11H2,1-2H3,(H,16,18).
What are the key properties of 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide?
2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide has a molecular weight of 276.34 g/mol, XLogP of 1.80, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide is sourced from PubChem (CID 83173338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).