HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Acetamide, N-[1-[tris(1-methylethyl)silyl]-1H-pyrrolo[2,3-B]pyridin-5-YL]-

HCID 22273659
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
651744-46-6
Standard SMILES
CC(=O)Nc1cnc2c(ccn2[Si](C(C)C)(C(C)C)C(C)C)c1
InChIKey
MOXCRKPENKYUPW-UHFFFAOYSA-N
Molecular formula
C18H29N3OSi
Average molar mass
331.5 g/mol
Monoisotopic mass
331.20798908

Names & identifiers

Preferred name
Acetamide, N-[1-[tris(1-methylethyl)silyl]-1H-pyrrolo[2,3-B]pyridin-5-YL]-
IUPAC
N-[1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-5-yl]acetamide
English name
Acetamide, N-[1-[tris(1-methylethyl)silyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]-
Molecular formula
C18H29N3OSi
Molecular weight
331.53

Names & synonyms

651744-46-6ACETAMIDE, N-[1-[TRIS(1-METHYLETHYL)SILYL]-1H-PYRROLO[2,3-B]PYRIDIN-5-YL]-SCHEMBL1683440DTXSID10624175MOXCRKPENKYUPW-UHFFFAOYSA-NN-(1-triisopropylsilanyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-acetamideN-{1-[Tri(propan-2-yl)silyl]-1H-pyrrolo[2,3-b]pyridin-5-yl}acetamideAcetamide,N-[1-[tris(1-methylethyl)silyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-5-yl]acetamide

Database identifiers

CAS
651744-46-6
PubChem CID
22273659
DTXSID
DTXSID10624175

Properties

Computed structural propertiesFilling in

Topological polar surface area
46.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
23
Formal charge
0
Complexity
403

Physicochemical properties

Boiling point
418.003 · 418.003±38.00 °C(Press: 760.00 Torr)(predicted)
Density
1.049 · 1.049±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
13.885 · 13.885±0.43(predicted)

Related reactions

2 records
New reaction record
HRID 1064260 reaction equation
HRID 1064260As productuspto-grants-2005_11
HRID 1551899 reaction equation
HRID 1551899As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes