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

2,2-Diphenylcyclopropylmethyl dimethylamine

HCID 522110
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
63968-76-3
Standard SMILES
CN(C)CC1CC1(c1ccccc1)c1ccccc1
InChIKey
OTVLFDNVIUPTQP-UHFFFAOYSA-N
Molecular formula
C18H21N
Average molar mass
251.4 g/mol
Monoisotopic mass
251.16739967

Names & identifiers

Preferred name
2,2-Diphenylcyclopropylmethyl dimethylamine
IUPAC
1-(2,2-diphenylcyclopropyl)-N,N-dimethylmethanamine

Names & synonyms

2,2-Diphenylcyclopropylmethyl dimethylamine1-(2,2-diphenylcyclopropyl)-N,N-dimethylmethanamineSCHEMBL11593081OTVLFDNVIUPTQP-UHFFFAOYSA-NDTXSID10123838663968-76-3N,N-dimethyl-2,2-diphenylcyclopropylmethylamineN,N-Dimethyl-2,2-diphenylcyclopropanemethanamine

Database identifiers

CAS
63968-76-3
PubChem CID
522110
DTXSID
DTXSID101238386

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
266

Related reactions

4 records
New reaction record
HRID 819311 reaction equation
HRID 819311As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1569832 reaction equation
HRID 1569832As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2420274 reaction equation
HRID 2420274As productuspto-grants-1978_08
HRID 2420275 reaction equation
HRID 2420275As productuspto-grants-1978_08

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes