2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide

C25H30N4O3 — CID 121238755

IUPAC2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide
SMILESCC(=O)Nc1cccc2c1ccn2CC(=O)Nc1ccc(OCCN2CCCCC2)cc1
InChIInChI=1S/C25H30N4O3/c1-19(30)26-23-6-5-7-24-22(23)12-15-29(24)18-25(31)27-20-8-10-21(11-9-20)32-17-16-28-13-3-2-4-14-28/h5-12,15H,2-4,13-14,16-18H2,1H3,(H,26,30)(H,27,31)
InChIKeyNDWWUQFQJJLBKO-UHFFFAOYSA-N
MW434.54 g/mol
LogP4.10
Rot. Bonds8

About 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide

2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide (PubChem CID 121238755) has the molecular formula C25H30N4O3 and a molecular weight of 434.54 g/mol. Its IUPAC name is 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide
PubChem CID121238755
Molecular FormulaC25H30N4O3
Molecular Weight434.54 g/mol
Exact Mass434.23
IUPAC Name2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide
SMILESCC(=O)Nc1cccc2c1ccn2CC(=O)Nc1ccc(OCCN2CCCCC2)cc1
InChIInChI=1S/C25H30N4O3/c1-19(30)26-23-6-5-7-24-22(23)12-15-29(24)18-25(31)27-20-8-10-21(11-9-20)32-17-16-28-13-3-2-4-14-28/h5-12,15H,2-4,13-14,16-18H2,1H3,(H,26,30)(H,27,31)
InChIKeyNDWWUQFQJJLBKO-UHFFFAOYSA-N
XLogP4.10
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-acetamidoindol-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 71827899
2-(4-acetamidoindol-1-yl)-N-cyclohexylacetamide
CID 71829005
2-(4-acetamidoindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 71828241
2-(azepan-1-yl)-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 54814562
2-(azepan-1-yl)-N-(4-heptoxyphenyl)acetamide
CID 54814498
ethyl N-[4-(2-piperidin-1-ylethoxy)phenyl]carbamate;hydrochloride
CID 24836577
N-[4-[2-(azepan-1-yl)ethoxy]phenyl]-2,2,2-trichloroacetamide
CID 100689409
2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]-N-(4-methylphenyl)acetamide
CID 9259187
methyl (2S)-2-[[2-(4-acetamidoindol-1-yl)acetyl]amino]-3-methylbutanoate
CID 91638079
2-methoxy-2,4-dimethyl-N-[4-(2-piperidin-1-ylethoxy)phenyl]pentanamide
CID 133245908
N-(4-ethoxyphenyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]acetamide
CID 9259318
N-[4-[2-(azepan-1-yl)ethoxy]phenyl]-1-phenylcyclohexane-1-carboxamide
CID 100669515

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide?
The IUPAC name of 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide (CID 121238755) is 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide?
The canonical SMILES for 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide is CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1ccc(OCCN2CCCCC2)cc1.
What is the InChIKey of 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide?
The InChIKey is NDWWUQFQJJLBKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O3/c1-19(30)26-23-6-5-7-24-22(23)12-15-29(24)18-25(31)27-20-8-10-21(11-9-20)32-17-16-28-13-3-2-4-14-28/h5-12,15H,2-4,13-14,16-18H2,1H3,(H,26,30)(H,27,31).
What are the key properties of 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide?
2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide has a molecular weight of 434.54 g/mol, XLogP of 4.10, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidoindol-1-yl)-N-[4-(2-piperidin-1-ylethoxy)phenyl]acetamide is sourced from PubChem (CID 121238755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).