2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide

C22H26N2O3 — CID 110831347

IUPAC2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide
SMILESCOc1cc(OC)c2ccn(C(C)C(=O)Nc3c(C)cc(C)cc3C)c2c1
InChIInChI=1S/C22H26N2O3/c1-13-9-14(2)21(15(3)10-13)23-22(25)16(4)24-8-7-18-19(24)11-17(26-5)12-20(18)27-6/h7-12,16H,1-6H3,(H,23,25)
InChIKeyYTWXDVONAMCMSW-UHFFFAOYSA-N
MW366.46 g/mol
LogP4.78
Rot. Bonds5

About 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide

2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide (PubChem CID 110831347) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide.

Molecular Properties

Compound Name2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide
PubChem CID110831347
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC Name2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide
SMILESCOc1cc(OC)c2ccn(C(C)C(=O)Nc3c(C)cc(C)cc3C)c2c1
InChIInChI=1S/C22H26N2O3/c1-13-9-14(2)21(15(3)10-13)23-22(25)16(4)24-8-7-18-19(24)11-17(26-5)12-20(18)27-6/h7-12,16H,1-6H3,(H,23,25)
InChIKeyYTWXDVONAMCMSW-UHFFFAOYSA-N
XLogP4.78
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4,6-dimethoxyindol-1-yl)-N-(2-methylpropyl)acetamide
CID 110830596
2-(4-oxopiperidin-1-yl)-N-(2,4,6-trimethylphenyl)propanamide
CID 82342693
2-amino-3-(2,4-dimethoxy-6-methylanilino)-3-oxopropanoic acid
CID 115179144
(4-methoxyphenyl)methyl-methyl-[(2S)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl]azanium
CID 9265127
2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)-N-(2,4,6-trimethylphenyl)propanamide
CID 44640223
(2S)-2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)-N-(2,4,6-trimethylphenyl)propanamide
CID 1412653
2-(3,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 53266252
(2R)-2-[5-(3-methoxyphenyl)-3-oxo-1,2,4-triazin-2-yl]-N-(2,4,6-trimethylphenyl)propanamide
CID 94009933
2-[5-(3-methoxyphenyl)-3-oxo-1,2,4-triazin-2-yl]-N-(2,4,6-trimethylphenyl)propanamide
CID 51345656
(2R)-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]-N-(2,4,6-trimethylphenyl)propanamide
CID 8805633
(2S)-2-(2,4-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 837680
(2R)-2-(2,4-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 837681

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide?
The IUPAC name of 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide (CID 110831347) is 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide.
What is the SMILES notation for 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide?
The canonical SMILES for 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide is COc1cc(OC)c2ccn(C(C)C(=O)Nc3c(C)cc(C)cc3C)c2c1.
What is the InChIKey of 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide?
The InChIKey is YTWXDVONAMCMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-13-9-14(2)21(15(3)10-13)23-22(25)16(4)24-8-7-18-19(24)11-17(26-5)12-20(18)27-6/h7-12,16H,1-6H3,(H,23,25).
What are the key properties of 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide?
2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide has a molecular weight of 366.46 g/mol, XLogP of 4.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethoxyindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide is sourced from PubChem (CID 110831347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).