N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide

C19H20N2O2 — CID 84582546

IUPACN-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NCCc2ccc3cc[nH]c3c2)cc1
InChIInChI=1S/C19H20N2O2/c1-14-2-6-17(7-3-14)23-13-19(22)21-10-8-15-4-5-16-9-11-20-18(16)12-15/h2-7,9,11-12,20H,8,10,13H2,1H3,(H,21,22)
InChIKeyQHADQOOFIZBTEX-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.21
Rot. Bonds6

About N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide

N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide (PubChem CID 84582546) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide
PubChem CID84582546
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NCCc2ccc3cc[nH]c3c2)cc1
InChIInChI=1S/C19H20N2O2/c1-14-2-6-17(7-3-14)23-13-19(22)21-10-8-15-4-5-16-9-11-20-18(16)12-15/h2-7,9,11-12,20H,8,10,13H2,1H3,(H,21,22)
InChIKeyQHADQOOFIZBTEX-UHFFFAOYSA-N
XLogP3.21
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methylphenoxy)-N-[2-(1H-pyrrol-3-yl)ethyl]acetamide
CID 110789370
N-[2-(4-aminophenyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 39384693
N-[2-(4-chlorophenyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 2632440
N-[2-(1H-indol-6-yl)ethyl]prop-1-en-2-amine
CID 144853621
N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide
CID 93165804
N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(4-methylphenoxy)acetamide
CID 112507216
2-(4-methylphenoxy)-N-[2-(1-methylpyrazol-4-yl)ethyl]acetamide
CID 47045575
2-(4-methylphenoxy)-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]acetamide
CID 113101573
N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-2-(4-methylphenoxy)acetamide
CID 110325904
N-[2-(cyclohexen-1-yl)ethyl]-2-(4-methylphenoxy)acetamide
CID 730729
2-(4-fluorophenoxy)-N-(1H-indol-6-yl)acetamide
CID 110730844
2-[4-(4-methylphenoxy)phenoxy]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 24632921

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide (CID 84582546) is N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide is Cc1ccc(OCC(=O)NCCc2ccc3cc[nH]c3c2)cc1.
What is the InChIKey of N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide?
The InChIKey is QHADQOOFIZBTEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-14-2-6-17(7-3-14)23-13-19(22)21-10-8-15-4-5-16-9-11-20-18(16)12-15/h2-7,9,11-12,20H,8,10,13H2,1H3,(H,21,22).
What are the key properties of N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide?
N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide has a molecular weight of 308.38 g/mol, XLogP of 3.21, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-6-yl)ethyl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 84582546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).