N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide

C19H20N2O2 — CID 87047149

IUPACN-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide
SMILESCCOc1cc(C)ccc1NC(=O)Cn1ccc2ccccc21
InChIInChI=1S/C19H20N2O2/c1-3-23-18-12-14(2)8-9-16(18)20-19(22)13-21-11-10-15-6-4-5-7-17(15)21/h4-12H,3,13H2,1-2H3,(H,20,22)
InChIKeyMTYFDORZRVABFO-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.99
Rot. Bonds5

About N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide

N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide (PubChem CID 87047149) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide.

Molecular Properties

Compound NameN-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide
PubChem CID87047149
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide
SMILESCCOc1cc(C)ccc1NC(=O)Cn1ccc2ccccc21
InChIInChI=1S/C19H20N2O2/c1-3-23-18-12-14(2)8-9-16(18)20-19(22)13-21-11-10-15-6-4-5-7-17(15)21/h4-12H,3,13H2,1-2H3,(H,20,22)
InChIKeyMTYFDORZRVABFO-UHFFFAOYSA-N
XLogP3.99
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N'-(2-indol-1-ylacetyl)benzohydrazide
CID 17080340
N-[4-[[2-(6-chloroindol-1-yl)acetyl]amino]-2,5-diethoxyphenyl]benzamide
CID 60567548
5-[(2-indol-1-ylacetyl)amino]-2,4-dimethylbenzoic acid
CID 138043722
2-(7-chloro-4-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)acetamide
CID 100738706
2-amino-N-(2-ethoxy-4-methylphenyl)benzamide
CID 60933793
N-(2-ethoxy-4-methylphenyl)-2-(3-methylphenoxy)acetamide
CID 87027069
N-(3-amino-2-methylphenyl)-2-indol-1-ylacetamide
CID 43247265
N-(2-ethoxy-4-methylphenyl)-3-(propan-2-ylamino)propanamide
CID 54862887
2-(3-aminophenyl)-N-(2-ethoxy-4-methylphenyl)acetamide
CID 62500140
2-(2,3-dihydro-1H-inden-1-yl)-N-(2-ethoxy-4-methylphenyl)acetamide
CID 86955608
1-[2-(2,4-dimethylanilino)-2-oxoethyl]-N-(2-ethoxyphenyl)piperidine-4-carboxamide
CID 16910200
N-ethyl-2-(5-methylindol-1-yl)acetamide
CID 116623028

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide?
The IUPAC name of N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide (CID 87047149) is N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide.
What is the SMILES notation for N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide?
The canonical SMILES for N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide is CCOc1cc(C)ccc1NC(=O)Cn1ccc2ccccc21.
What is the InChIKey of N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide?
The InChIKey is MTYFDORZRVABFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-3-23-18-12-14(2)8-9-16(18)20-19(22)13-21-11-10-15-6-4-5-7-17(15)21/h4-12H,3,13H2,1-2H3,(H,20,22).
What are the key properties of N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide?
N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide has a molecular weight of 308.38 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-4-methylphenyl)-2-indol-1-ylacetamide is sourced from PubChem (CID 87047149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).