2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide

C20H20N2O2 — CID 972360

IUPAC2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1cc(C(=O)c2ccccc2)c2ccccc21
InChIInChI=1S/C20H20N2O2/c1-14(2)21-19(23)13-22-12-17(16-10-6-7-11-18(16)22)20(24)15-8-4-3-5-9-15/h3-12,14H,13H2,1-2H3,(H,21,23)
InChIKeyGXAVMTSYHCCHFK-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.40
Rot. Bonds5

About 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide

2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide (PubChem CID 972360) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide
PubChem CID972360
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1cc(C(=O)c2ccccc2)c2ccccc21
InChIInChI=1S/C20H20N2O2/c1-14(2)21-19(23)13-22-12-17(16-10-6-7-11-18(16)22)20(24)15-8-4-3-5-9-15/h3-12,14H,13H2,1-2H3,(H,21,23)
InChIKeyGXAVMTSYHCCHFK-UHFFFAOYSA-N
XLogP3.40
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-benzoylindol-1-yl)-N-(2,3-dimethylphenyl)acetamide
CID 2953381
2-(3-benzoylindol-1-yl)-N-cyclohexylacetamide
CID 2202973
2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide
CID 2953380
2-(3-benzoylindol-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 1089001
2-[3-(furan-2-carbonyl)indol-1-yl]-N-[(1S)-1-phenylethyl]acetamide
CID 1096041
2-(3-benzoylindol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 2974288
1-(3-benzoylindol-1-yl)-3-(4-methylphenyl)propan-2-one
CID 164961814
2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide
CID 53027926
(4-methylphenyl)-[1-(2-methylpropyl)indol-3-yl]methanone
CID 102235826
2-[3-(4-chlorobenzoyl)indol-1-yl]-N-[(2-methylphenyl)methyl]acetamide
CID 164781411
(3-fluorophenyl)-[1-(2-methylpropyl)indol-3-yl]methanone
CID 170857242
[1-(4-hydroxybutan-2-yl)indol-3-yl]-phenylmethanone
CID 70526670

Frequently Asked Questions

What is the IUPAC name of 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide (CID 972360) is 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1cc(C(=O)c2ccccc2)c2ccccc21.
What is the InChIKey of 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide?
The InChIKey is GXAVMTSYHCCHFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-14(2)21-19(23)13-22-12-17(16-10-6-7-11-18(16)22)20(24)15-8-4-3-5-9-15/h3-12,14H,13H2,1-2H3,(H,21,23).
What are the key properties of 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide?
2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide has a molecular weight of 320.39 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 972360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).