2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide

C22H26N2O3 — CID 113210171

IUPAC2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide
SMILESCOc1cccc(CCNC(=O)C(C)(C)c2c[nH]c3ccc(OC)cc23)c1
InChIInChI=1S/C22H26N2O3/c1-22(2,19-14-24-20-9-8-17(27-4)13-18(19)20)21(25)23-11-10-15-6-5-7-16(12-15)26-3/h5-9,12-14,24H,10-11H2,1-4H3,(H,23,25)
InChIKeyWSZMWEGFYKHDIN-UHFFFAOYSA-N
MW366.46 g/mol
LogP3.82
Rot. Bonds7

About 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide

2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide (PubChem CID 113210171) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide
PubChem CID113210171
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC Name2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide
SMILESCOc1cccc(CCNC(=O)C(C)(C)c2c[nH]c3ccc(OC)cc23)c1
InChIInChI=1S/C22H26N2O3/c1-22(2,19-14-24-20-9-8-17(27-4)13-18(19)20)21(25)23-11-10-15-6-5-7-16(12-15)26-3/h5-9,12-14,24H,10-11H2,1-4H3,(H,23,25)
InChIKeyWSZMWEGFYKHDIN-UHFFFAOYSA-N
XLogP3.82
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-chlorophenyl)ethyl]-2-(5-methoxy-1H-indol-3-yl)-2-methylpropanamide
CID 113210204
N-[3-(dimethylamino)propyl]-2-(5-methoxy-1H-indol-3-yl)-2-methylpropanamide
CID 113210143
2-(3-methoxyphenyl)ethyl N-[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamate
CID 6733827
N-(1,3-benzodioxol-5-ylmethyl)-2-(5-methoxy-1H-indol-3-yl)-2-methylpropanamide
CID 113210161
2-carbamothioyl-N-[2-(3-methoxyphenyl)ethyl]-2-methylbutanamide
CID 107854485
N'-[2-(1H-indol-3-yl)ethyl]-N-[2-(3-methoxyphenyl)ethyl]propanediamide
CID 108948641
N-cyclopentyl-2-(5-methoxy-1H-indol-3-yl)-2-methylpropanamide
CID 113210132
2-amino-N-[2-(3-methoxyphenyl)ethyl]-2-methylbutanamide
CID 107842874
methyl 2-[[2-(5-methoxy-1H-indol-3-yl)-2-methylpropanoyl]amino]benzoate
CID 113210255
2-(1H-indol-3-yl)-N-[2-(2-methoxyphenyl)ethyl]-2-methylpropanamide
CID 113208953
5-methoxy-N-[2-(3-methoxyphenyl)ethyl]-1H-indole-2-carboxamide
CID 113207269
N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]-2-(4-methoxyphenyl)acetamide
CID 113084367

Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide?
The IUPAC name of 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide (CID 113210171) is 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide.
What is the SMILES notation for 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide?
The canonical SMILES for 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide is COc1cccc(CCNC(=O)C(C)(C)c2c[nH]c3ccc(OC)cc23)c1.
What is the InChIKey of 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide?
The InChIKey is WSZMWEGFYKHDIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-22(2,19-14-24-20-9-8-17(27-4)13-18(19)20)21(25)23-11-10-15-6-5-7-16(12-15)26-3/h5-9,12-14,24H,10-11H2,1-4H3,(H,23,25).
What are the key properties of 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide?
2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide has a molecular weight of 366.46 g/mol, XLogP of 3.82, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-1H-indol-3-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-methylpropanamide is sourced from PubChem (CID 113210171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).