N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide

C19H18N2O3 — CID 113208450

IUPACN-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide
SMILESCCc1ccccc1NC(=O)C(=O)c1c[nH]c2ccc(OC)cc12
InChIInChI=1S/C19H18N2O3/c1-3-12-6-4-5-7-16(12)21-19(23)18(22)15-11-20-17-9-8-13(24-2)10-14(15)17/h4-11,20H,3H2,1-2H3,(H,21,23)
InChIKeyQKJDAUGUXYMKAP-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.56
Rot. Bonds5

About N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide

N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide (PubChem CID 113208450) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide
PubChem CID113208450
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide
SMILESCCc1ccccc1NC(=O)C(=O)c1c[nH]c2ccc(OC)cc12
InChIInChI=1S/C19H18N2O3/c1-3-12-6-4-5-7-16(12)21-19(23)18(22)15-11-20-17-9-8-13(24-2)10-14(15)17/h4-11,20H,3H2,1-2H3,(H,21,23)
InChIKeyQKJDAUGUXYMKAP-UHFFFAOYSA-N
XLogP3.56
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,6-diethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide
CID 113208457
2-(5-methoxy-1H-indol-3-yl)-N-(2-methylphenyl)-2-oxoacetamide
CID 113208438
N-benzyl-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide
CID 113208378
N-(2-ethoxyphenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206077
methyl 2-[[2-(5-methoxy-1H-indol-3-yl)acetyl]amino]benzoate
CID 113209687
N-(2,4-dimethoxyphenyl)-N'-(2-ethylphenyl)oxamide
CID 3220613
5-methoxy-N-[(2-methoxyphenyl)methyl]-1H-indole-3-carboxamide
CID 113205982
2-(5-methoxy-1H-indol-3-yl)-N-(3-methylbutyl)-2-oxoacetamide
CID 113208428
2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide
CID 44719462
ethyl (2S)-2-[[2-(5-methoxy-1H-indol-3-yl)-2-oxoacetyl]amino]-3-phenylpropanoate
CID 14541515
N-(2,3-dimethylphenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206047
N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 16764740

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide?
The IUPAC name of N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide (CID 113208450) is N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide?
The canonical SMILES for N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide is CCc1ccccc1NC(=O)C(=O)c1c[nH]c2ccc(OC)cc12.
What is the InChIKey of N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide?
The InChIKey is QKJDAUGUXYMKAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-3-12-6-4-5-7-16(12)21-19(23)18(22)15-11-20-17-9-8-13(24-2)10-14(15)17/h4-11,20H,3H2,1-2H3,(H,21,23).
What are the key properties of N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide?
N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide has a molecular weight of 322.36 g/mol, XLogP of 3.56, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide is sourced from PubChem (CID 113208450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).