2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide

C19H21N3O2 — CID 91822099

IUPAC2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
SMILESCC(C)n1ccc2c(OCC(=O)NCc3ccccn3)cccc21
InChIInChI=1S/C19H21N3O2/c1-14(2)22-11-9-16-17(22)7-5-8-18(16)24-13-19(23)21-12-15-6-3-4-10-20-15/h3-11,14H,12-13H2,1-2H3,(H,21,23)
InChIKeyKBKUZIBMVHUFFD-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.31
Rot. Bonds6

About 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide

2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 91822099) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
PubChem CID91822099
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
SMILESCC(C)n1ccc2c(OCC(=O)NCc3ccccn3)cccc21
InChIInChI=1S/C19H21N3O2/c1-14(2)22-11-9-16-17(22)7-5-8-18(16)24-13-19(23)21-12-15-6-3-4-10-20-15/h3-11,14H,12-13H2,1-2H3,(H,21,23)
InChIKeyKBKUZIBMVHUFFD-UHFFFAOYSA-N
XLogP3.31
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide
CID 91821459
N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(1-propan-2-ylindol-4-yl)oxyacetamide
CID 110205323
N-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]-2-(1-propan-2-ylindol-4-yl)oxyacetamide
CID 91823188
2-(1-propan-2-ylindol-4-yl)oxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 91822455
2-phenoxy-N-(pyridin-2-ylmethyl)acetamide
CID 853197
N-(1,1-dioxothiolan-3-yl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide
CID 91823205
N-[(3S)-1,1-dioxothiolan-3-yl]-2-(1-propan-2-ylindol-4-yl)oxyacetamide
CID 124855022
2-(2-nitrophenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 27554275
2-(5-bromo-1-propan-2-ylindol-3-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 171476841
2-(4-propoxyphenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 35750358
4-hydroxy-N-(pyridin-2-ylmethyl)pentanamide
CID 79016708
2-(2-propan-2-yloxyanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999278

Frequently Asked Questions

What is the IUPAC name of 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide (CID 91822099) is 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide is CC(C)n1ccc2c(OCC(=O)NCc3ccccn3)cccc21.
What is the InChIKey of 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is KBKUZIBMVHUFFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-14(2)22-11-9-16-17(22)7-5-8-18(16)24-13-19(23)21-12-15-6-3-4-10-20-15/h3-11,14H,12-13H2,1-2H3,(H,21,23).
What are the key properties of 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide?
2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 323.40 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propan-2-ylindol-4-yl)oxy-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 91822099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).