2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide

C19H18N2O3 — CID 1088565

IUPAC2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cn2cc(C(C)=O)c3ccccc32)cc1
InChIInChI=1S/C19H18N2O3/c1-13(22)17-11-21(18-6-4-3-5-16(17)18)12-19(23)20-14-7-9-15(24-2)10-8-14/h3-11H,12H2,1-2H3,(H,20,23)
InChIKeyACVYGVOBIRTUOJ-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.49
Rot. Bonds5

About 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide

2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide (PubChem CID 1088565) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide
PubChem CID1088565
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cn2cc(C(C)=O)c3ccccc32)cc1
InChIInChI=1S/C19H18N2O3/c1-13(22)17-11-21(18-6-4-3-5-16(17)18)12-19(23)20-14-7-9-15(24-2)10-8-14/h3-11H,12H2,1-2H3,(H,20,23)
InChIKeyACVYGVOBIRTUOJ-UHFFFAOYSA-N
XLogP3.49
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-[2-oxo-2-[4-(phenylcarbamoylamino)anilino]ethyl]indole-3-carboxylate
CID 46553530
2-(3-acetylindol-1-yl)-N-[2-(5-methoxyindol-1-yl)ethyl]acetamide
CID 56763655
2-[3-(benzenesulfonyl)-4-oxoquinolin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 20869284
2-(3-acetylindol-1-yl)-N-tert-butylacetamide
CID 972491
2-[3-(4-methoxyphenyl)sulfonyl-4-oxoquinolin-1-yl]-N-phenylacetamide
CID 2137964
2-(3-benzoyl-6-chloro-4-oxoquinolin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 18560102
2-(3-acetylindol-1-yl)-N-propylacetamide
CID 117098452
2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide
CID 21373971
2-(1-benzylindol-3-yl)-N-(4-methoxyphenyl)-2-oxoacetamide
CID 155797600
2-[3-(4-ethoxyphenyl)sulfonyl-4-oxoquinolin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 16825265
N-(4-methoxyphenyl)-4-oxo-1-pentylquinoline-3-carboxamide
CID 11523434
methyl 1-[2-[4-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]indole-3-carboxylate
CID 46553810

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide (CID 1088565) is 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)Cn2cc(C(C)=O)c3ccccc32)cc1.
What is the InChIKey of 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide?
The InChIKey is ACVYGVOBIRTUOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-13(22)17-11-21(18-6-4-3-5-16(17)18)12-19(23)20-14-7-9-15(24-2)10-8-14/h3-11H,12H2,1-2H3,(H,20,23).
What are the key properties of 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide?
2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide has a molecular weight of 322.36 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 1088565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).