2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide

C21H24N2O3 — CID 110371484

IUPAC2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide
SMILESCCOc1ccc(CC(=O)NCc2cn(C)c3ccc(OC)cc23)cc1
InChIInChI=1S/C21H24N2O3/c1-4-26-17-7-5-15(6-8-17)11-21(24)22-13-16-14-23(2)20-10-9-18(25-3)12-19(16)20/h5-10,12,14H,4,11,13H2,1-3H3,(H,22,24)
InChIKeyMXXMTOPAALDRJC-UHFFFAOYSA-N
MW352.43 g/mol
LogP3.44
Rot. Bonds7

About 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide

2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide (PubChem CID 110371484) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide
PubChem CID110371484
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide
SMILESCCOc1ccc(CC(=O)NCc2cn(C)c3ccc(OC)cc23)cc1
InChIInChI=1S/C21H24N2O3/c1-4-26-17-7-5-15(6-8-17)11-21(24)22-13-16-14-23(2)20-10-9-18(25-3)12-19(16)20/h5-10,12,14H,4,11,13H2,1-3H3,(H,22,24)
InChIKeyMXXMTOPAALDRJC-UHFFFAOYSA-N
XLogP3.44
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethoxy-N-[(4-methoxyphenyl)methyl]-1-methyl-4-oxoquinoline-3-carboxamide
CID 30133854
1-(5-ethoxy-1-methylindol-3-yl)propan-2-one
CID 82495412
2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110324772
2-(5-ethoxy-1-methylindol-3-yl)ethanol
CID 82278619
N-[(2-ethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 38009470
N-ethyl-2-(5-methoxy-1-methylindol-3-yl)ethanamine
CID 96673433
2-(4-ethoxyphenyl)-N-[(2-fluorophenyl)methyl]acetamide
CID 17068473
N-[(5-methoxy-1-methylindol-3-yl)methyl]-2,4-dimethylbenzenesulfonamide
CID 110371530
N-(1,3-benzodioxol-5-ylmethyl)-6-ethoxy-1-methyl-4-oxoquinoline-3-carboxamide
CID 30134009
3-(5-ethoxy-1-methylindol-3-yl)-N-methylpropan-1-amine
CID 98784252
N-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethyl]butanamide
CID 108573115
N-[2-(5-methoxyindol-1-yl)ethyl]-2-(1-methylindol-3-yl)acetamide
CID 91637888

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide?
The IUPAC name of 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide (CID 110371484) is 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide?
The canonical SMILES for 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide is CCOc1ccc(CC(=O)NCc2cn(C)c3ccc(OC)cc23)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide?
The InChIKey is MXXMTOPAALDRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-4-26-17-7-5-15(6-8-17)11-21(24)22-13-16-14-23(2)20-10-9-18(25-3)12-19(16)20/h5-10,12,14H,4,11,13H2,1-3H3,(H,22,24).
What are the key properties of 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide?
2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide has a molecular weight of 352.43 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide is sourced from PubChem (CID 110371484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).