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

4H-Pyrido(1,2-a)pyrimidine-3-carboxamide, 6-methyl-4-oxo-N-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-

HCID 3079296
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
125055-74-5
Standard SMILES
Cc1cccc2ncc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)n12
InChIKey
FNVVUVJVDUVZAK-UHFFFAOYSA-N
Molecular formula
C20H23N3O2
Average molar mass
337.4 g/mol
Monoisotopic mass
337.17902698

Names & identifiers

Preferred name
4H-Pyrido(1,2-a)pyrimidine-3-carboxamide, 6-methyl-4-oxo-N-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-
IUPAC
N-(1-adamantyl)-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

Names & synonyms

4H-Pyrido(1,2-a)pyrimidine-3-carboxamide, 6-methyl-4-oxo-N-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-125055-74-56-Methyl-4-oxo-N-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-4H-pyrido(1,2-a)pyrimidine-3-carboxamideDTXSID90154581RefChem:297754DTXCID9077072SCHEMBL9595717FNVVUVJVDUVZAK-UHFFFAOYSA-NN-adamantyl-6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamideN-(ADAMANTAN-1-YL)-6-METHYL-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDINE-3-CARBOXAMIDE

Database identifiers

CAS
125055-74-5
PubChem CID
3079296
DTXSID
DTXSID90154581

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
61.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
25
Formal charge
0
Complexity
745

Related reactions

3 records
New reaction record
HRID 467027 reaction equation
HRID 467027As productuspto-grants-1992_10
HRID 800258 reaction equation
HRID 800258As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1655924 reaction equation
HRID 1655924As productuspto-grants-1993_10

Compound notes

Loading…

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