2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide

C24H22N2O2 — CID 21373971

IUPAC2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide
SMILESCC(C)C(=O)c1cn(CC(=O)Nc2ccc3ccccc3c2)c2ccccc12
InChIInChI=1S/C24H22N2O2/c1-16(2)24(28)21-14-26(22-10-6-5-9-20(21)22)15-23(27)25-19-12-11-17-7-3-4-8-18(17)13-19/h3-14,16H,15H2,1-2H3,(H,25,27)
InChIKeyINVZXYFUIDIPNQ-UHFFFAOYSA-N
MW370.45 g/mol
LogP5.27
Rot. Bonds5

About 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide

2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide (PubChem CID 21373971) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide.

Molecular Properties

Compound Name2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide
PubChem CID21373971
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide
SMILESCC(C)C(=O)c1cn(CC(=O)Nc2ccc3ccccc3c2)c2ccccc12
InChIInChI=1S/C24H22N2O2/c1-16(2)24(28)21-14-26(22-10-6-5-9-20(21)22)15-23(27)25-19-12-11-17-7-3-4-8-18(17)13-19/h3-14,16H,15H2,1-2H3,(H,25,27)
InChIKeyINVZXYFUIDIPNQ-UHFFFAOYSA-N
XLogP5.27
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.45
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-2-[3-(2-methylpropanoyl)indol-1-yl]acetamide
CID 3157256
2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 1088565
methyl 1-[2-oxo-2-[4-(phenylcarbamoylamino)anilino]ethyl]indole-3-carboxylate
CID 46553530
N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-2-[3-(2-methylpropanoyl)indol-1-yl]acetamide
CID 95081109
2-[1-[2-(4-chloroanilino)-2-oxoethyl]indol-3-yl]-2-oxoacetamide
CID 5302279
2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide
CID 2953380
methyl 1-[2-(2-naphthalen-2-ylethylamino)-2-oxoethyl]indole-3-carboxylate
CID 35028911
2-(3-propanoylindol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 1255387
N-(1,3-benzodioxol-5-yl)-2-[3-(4-fluorobenzoyl)-4-oxoquinolin-1-yl]acetamide
CID 20868909
2-[3-(4-ethylbenzoyl)-4-oxoquinolin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 16825310
[(2S)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl] 1-methylindole-3-carboxylate
CID 8816900
N-(4-methylphenyl)-2-[3-(thiophene-2-carbonyl)indol-1-yl]acetamide
CID 5043393

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide?
The IUPAC name of 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide (CID 21373971) is 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide.
What is the SMILES notation for 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide?
The canonical SMILES for 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide is CC(C)C(=O)c1cn(CC(=O)Nc2ccc3ccccc3c2)c2ccccc12.
What is the InChIKey of 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide?
The InChIKey is INVZXYFUIDIPNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-16(2)24(28)21-14-26(22-10-6-5-9-20(21)22)15-23(27)25-19-12-11-17-7-3-4-8-18(17)13-19/h3-14,16H,15H2,1-2H3,(H,25,27).
What are the key properties of 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide?
2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide has a molecular weight of 370.45 g/mol, XLogP of 5.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methylpropanoyl)indol-1-yl]-N-naphthalen-2-ylacetamide is sourced from PubChem (CID 21373971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).