2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide

C22H19N3O — CID 3659889

IUPAC2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide
SMILESCC(=NNC(=O)Cn1ccc2ccccc21)c1ccc2ccccc2c1
InChIInChI=1S/C22H19N3O/c1-16(19-11-10-17-6-2-3-8-20(17)14-19)23-24-22(26)15-25-13-12-18-7-4-5-9-21(18)25/h2-14H,15H2,1H3,(H,24,26)
InChIKeyXHMGSEPSAGZOST-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.33
Rot. Bonds4

About 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide

2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide (PubChem CID 3659889) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide.

Molecular Properties

Compound Name2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide
PubChem CID3659889
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC Name2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide
SMILESCC(=NNC(=O)Cn1ccc2ccccc21)c1ccc2ccccc2c1
InChIInChI=1S/C22H19N3O/c1-16(19-11-10-17-6-2-3-8-20(17)14-19)23-24-22(26)15-25-13-12-18-7-4-5-9-21(18)25/h2-14H,15H2,1H3,(H,24,26)
InChIKeyXHMGSEPSAGZOST-UHFFFAOYSA-N
XLogP4.33
TPSA46.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-indol-1-yl-N-[1-(4-methylphenyl)ethylideneamino]acetamide
CID 4258982
N-[(Z)-1-(4-aminophenyl)ethylideneamino]-2-indol-1-ylacetamide
CID 17080225
N-[(Z)-1-(4-chlorophenyl)ethylideneamino]-2-indol-1-ylacetamide
CID 6284969
N-[1-(4-chlorophenyl)ethylideneamino]-2-indol-1-ylacetamide
CID 5150836
2-indol-1-yl-N-[(E)-1-thiophen-2-ylethylideneamino]acetamide
CID 17080231
2-indol-1-yl-N-[(E)-1-(2-methoxyphenyl)ethylideneamino]acetamide
CID 7316808
N,N'-bis[(Z)-1-naphthalen-2-ylethylideneamino]nonanediamide
CID 92652613
N,N'-bis(1-naphthalen-2-ylethylideneamino)octanediamide
CID 4172674
N-(1-naphthalen-2-ylethylideneamino)-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 5223322
N-(1-naphthalen-2-ylethylideneamino)-2-phenoxyacetamide
CID 913446
N'-acetyl-2-indol-1-ylacetohydrazide
CID 4587603
N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide
CID 951064

Frequently Asked Questions

What is the IUPAC name of 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide?
The IUPAC name of 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide (CID 3659889) is 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide.
What is the SMILES notation for 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide?
The canonical SMILES for 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide is CC(=NNC(=O)Cn1ccc2ccccc21)c1ccc2ccccc2c1.
What is the InChIKey of 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide?
The InChIKey is XHMGSEPSAGZOST-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c1-16(19-11-10-17-6-2-3-8-20(17)14-19)23-24-22(26)15-25-13-12-18-7-4-5-9-21(18)25/h2-14H,15H2,1H3,(H,24,26).
What are the key properties of 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide?
2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide has a molecular weight of 341.41 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indol-1-yl-N-(1-naphthalen-2-ylethylideneamino)acetamide is sourced from PubChem (CID 3659889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).