2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide

C21H19N3O2 — CID 20879509

IUPAC2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide
SMILESCc1cc2ccccc2n1CCNC(=O)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C21H19N3O2/c1-14-12-15-6-2-5-9-19(15)24(14)11-10-22-21(26)20(25)17-13-23-18-8-4-3-7-16(17)18/h2-9,12-13,23H,10-11H2,1H3,(H,22,26)
InChIKeyFCDDWQLVFQHJMJ-UHFFFAOYSA-N
MW345.40 g/mol
LogP3.43
Rot. Bonds5

About 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide

2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide (PubChem CID 20879509) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide
PubChem CID20879509
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide
SMILESCc1cc2ccccc2n1CCNC(=O)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C21H19N3O2/c1-14-12-15-6-2-5-9-19(15)24(14)11-10-22-21(26)20(25)17-13-23-18-8-4-3-7-16(17)18/h2-9,12-13,23H,10-11H2,1H3,(H,22,26)
InChIKeyFCDDWQLVFQHJMJ-UHFFFAOYSA-N
XLogP3.43
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.43
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-(2-methylindol-1-yl)ethyl]acetamide
CID 4287474
7-methyl-N-[2-(2-methylindol-1-yl)ethyl]-4-oxo-1H-1,8-naphthyridine-3-carboxamide
CID 126578263
N-[2-(2-methylindol-1-yl)ethyl]-2,2-diphenylacetamide
CID 3473428
2-(1H-indol-3-yl)-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-oxoacetamide
CID 71789720
4-chloro-N-[2-(2-methylindol-1-yl)ethyl]benzamide
CID 3311967
4-tert-butyl-N-[2-(2-methylindol-1-yl)ethyl]benzamide
CID 3314807
4-bromo-N-[2-(2-methylindol-1-yl)ethyl]benzamide
CID 4144460
tert-butyl 2-[[2-(1H-indol-3-yl)-2-oxoacetyl]amino]acetate
CID 10040581
N-[2-(2-methylindol-1-yl)ethyl]-2,5-dihydro-1H-pyrrole-2-carboxamide;hydrochloride
CID 154911026
2-(1H-indol-3-yl)-2-oxo-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)acetamide
CID 71790725
N-[3-(N-ethylanilino)propyl]-2-(1H-indol-3-yl)-2-oxoacetamide
CID 7087100
N-(furan-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide
CID 11630378

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide (CID 20879509) is 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide is Cc1cc2ccccc2n1CCNC(=O)C(=O)c1c[nH]c2ccccc12.
What is the InChIKey of 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide?
The InChIKey is FCDDWQLVFQHJMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-14-12-15-6-2-5-9-19(15)24(14)11-10-22-21(26)20(25)17-13-23-18-8-4-3-7-16(17)18/h2-9,12-13,23H,10-11H2,1H3,(H,22,26).
What are the key properties of 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide?
2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide has a molecular weight of 345.40 g/mol, XLogP of 3.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-[2-(2-methylindol-1-yl)ethyl]-2-oxoacetamide is sourced from PubChem (CID 20879509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).