2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide

C22H24N2O3 — CID 110669146

IUPAC2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide
SMILESCOc1ccc(C(=O)CNC(=O)Cc2c[nH]c3ccccc23)cc1C(C)C
InChIInChI=1S/C22H24N2O3/c1-14(2)18-10-15(8-9-21(18)27-3)20(25)13-24-22(26)11-16-12-23-19-7-5-4-6-17(16)19/h4-10,12,14,23H,11,13H2,1-3H3,(H,24,26)
InChIKeySDZNSTZCBIXAFF-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.84
Rot. Bonds7

About 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide

2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide (PubChem CID 110669146) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide
PubChem CID110669146
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide
SMILESCOc1ccc(C(=O)CNC(=O)Cc2c[nH]c3ccccc23)cc1C(C)C
InChIInChI=1S/C22H24N2O3/c1-14(2)18-10-15(8-9-21(18)27-3)20(25)13-24-22(26)11-16-12-23-19-7-5-4-6-17(16)19/h4-10,12,14,23H,11,13H2,1-3H3,(H,24,26)
InChIKeySDZNSTZCBIXAFF-UHFFFAOYSA-N
XLogP3.84
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
2-(1H-indol-3-yl)-N-[1-(2-methoxyphenyl)ethyl]-N-methylacetamide
CID 46591974
N-[2-(1H-indol-3-yl)ethyl]-2-(2-methoxyphenyl)acetamide
CID 4796568
N-[2-(4-acetylanilino)-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 112999594
N-(1H-indol-3-ylmethyl)-1-(2-methoxyphenyl)ethanamine
CID 60663811
(1R)-N-(1H-indol-3-ylmethyl)-1-(2-methoxyphenyl)ethanamine
CID 81389478
methyl 3-[[2-(1H-indol-3-yl)acetyl]amino]propanoate
CID 2539049
N-(1H-indol-3-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 110357464
[2-[4-(difluoromethoxy)-3-methoxyphenyl]-2-oxoethyl] 2-(1H-indol-3-yl)acetate
CID 8895035
3-bromo-4-ethoxy-N'-[2-(1H-indol-3-yl)acetyl]-5-methoxybenzohydrazide
CID 39972648
N-(1H-indol-3-ylmethyl)-2-(2-methoxyphenoxy)acetamide
CID 110357480
2-(6-chloro-1H-indol-3-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 113209736

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide (CID 110669146) is 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide is COc1ccc(C(=O)CNC(=O)Cc2c[nH]c3ccccc23)cc1C(C)C.
What is the InChIKey of 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide?
The InChIKey is SDZNSTZCBIXAFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-14(2)18-10-15(8-9-21(18)27-3)20(25)13-24-22(26)11-16-12-23-19-7-5-4-6-17(16)19/h4-10,12,14,23H,11,13H2,1-3H3,(H,24,26).
What are the key properties of 2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide?
2-(1H-indol-3-yl)-N-[2-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide has a molecular weight of 364.45 g/mol, XLogP of 3.84, 7 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-(4-methoxy-3-propan-2-ylphenyl)-2-oxoethyl]acetamide is sourced from PubChem (CID 110669146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).