HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

4-Chloro-7-(cyclopropylmethyl)-7H-pyrrolo[2,3-d]pyrimidine

HCID 73554645
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Clc1ncnc2c1ccn2CC1CC1
InChIKey
DKEISTFEIIXFRF-UHFFFAOYSA-N
Molecular formula
C10H10ClN3
Average molar mass
207.66 g/mol
Monoisotopic mass
207.056325

Names & identifiers

Preferred name
4-Chloro-7-(cyclopropylmethyl)-7H-pyrrolo[2,3-d]pyrimidine
IUPAC
4-chloro-7-(cyclopropylmethyl)pyrrolo[2,3-d]pyrimidine

Names & synonyms

4-Chloro-7-(cyclopropylmethyl)-7H-pyrrolo[2,3-d]pyrimidine717900-71-54-CHLORO-7-(CYCLOPROPYLMETHYL)PYRROLO[2,3-D]PYRIMIDINESCHEMBL1941046DKEISTFEIIXFRF-UHFFFAOYSA-NMFCD27996449A1-269574-Chloro-7-cyclopropylmethyl-7H-pyrrolo[2,3-d]pyrimidine

Database identifiers

PubChem CID
73554645

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
30.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
219

Related reactions

4 records
New reaction record
HRID 687462 reaction equation
HRID 687462As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 916776 reaction equation
HRID 916776As productuspto-grants-2007_09
HRID 916777 reaction equation
HRID 916777As reactantuspto-grants-2007_09
HRID 1115039 reaction equation
HRID 1115039As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes