N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide

C23H24N2O4 — CID 4212528

IUPACN-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide
SMILESO=C(Cn1cc(C(=O)COc2ccccc2)c2ccccc21)NCC1CCCO1
InChIInChI=1S/C23H24N2O4/c26-22(16-29-17-7-2-1-3-8-17)20-14-25(21-11-5-4-10-19(20)21)15-23(27)24-13-18-9-6-12-28-18/h1-5,7-8,10-11,14,18H,6,9,12-13,15-16H2,(H,24,27)
InChIKeyCNUYORNVDYUYGG-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.20
Rot. Bonds8

About N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide

N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide (PubChem CID 4212528) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide
PubChem CID4212528
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide
SMILESO=C(Cn1cc(C(=O)COc2ccccc2)c2ccccc21)NCC1CCCO1
InChIInChI=1S/C23H24N2O4/c26-22(16-29-17-7-2-1-3-8-17)20-14-25(21-11-5-4-10-19(20)21)15-23(27)24-13-18-9-6-12-28-18/h1-5,7-8,10-11,14,18H,6,9,12-13,15-16H2,(H,24,27)
InChIKeyCNUYORNVDYUYGG-UHFFFAOYSA-N
XLogP3.20
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-(cyclopropanecarbonyl)indol-1-yl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 963184
N-[[(2S)-oxolan-2-yl]methyl]-2-[3-(2-oxo-2-pyrrolidin-1-ylacetyl)indol-1-yl]acetamide
CID 97465954
2-(3-cyanoindol-1-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 2912319
[2-oxo-2-(oxolan-2-ylmethylamino)ethyl] 1-ethylindole-3-carboxylate
CID 42890150
2-[3-[(4-methylphenyl)methylsulfonyl]indol-1-yl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 26745583
2-oxo-N-(oxolan-2-ylmethyl)-2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]acetamide
CID 16808099
2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-(oxolan-2-ylmethyl)acetamide
CID 16935785
2-[3-[(2-chlorophenyl)methylsulfonyl]indol-1-yl]-N-(oxolan-2-ylmethyl)acetamide
CID 18564611
2-indol-1-yl-N-(oxolan-2-ylmethyl)acetamide
CID 5125884
N-(2,3-dimethylphenyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide
CID 3978712
N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 18168439
2-[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]sulfanyl-N-(oxolan-2-ylmethyl)acetamide
CID 20902541

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide (CID 4212528) is N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide is O=C(Cn1cc(C(=O)COc2ccccc2)c2ccccc21)NCC1CCCO1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide?
The InChIKey is CNUYORNVDYUYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c26-22(16-29-17-7-2-1-3-8-17)20-14-25(21-11-5-4-10-19(20)21)15-23(27)24-13-18-9-6-12-28-18/h1-5,7-8,10-11,14,18H,6,9,12-13,15-16H2,(H,24,27).
What are the key properties of N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide?
N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide has a molecular weight of 392.46 g/mol, XLogP of 3.20, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-2-[3-(2-phenoxyacetyl)indol-1-yl]acetamide is sourced from PubChem (CID 4212528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).