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

2-Amino-3-piperidin-1-ylnaphthalene-1,4-dione

HCID 2833775
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
5212-52-2
Standard SMILES
NC1=C(N2CCCCC2)C(=O)c2ccccc2C1=O
InChIKey
OIVVDSYDWBNNOM-UHFFFAOYSA-N
Molecular formula
C15H16N2O2
Average molar mass
256.3 g/mol
Monoisotopic mass
256.12117776

Names & identifiers

Preferred name
2-Amino-3-piperidin-1-ylnaphthalene-1,4-dione
IUPAC
2-amino-3-piperidin-1-ylnaphthalene-1,4-dione

Names & synonyms

2-amino-3-piperidin-1-ylnaphthalene-1,4-dione5212-52-2DTXSID40385368RefChem:255407DTXCID003363912-amino-3-(piperidin-1-yl)naphthalene-1,4-dioneCBMicro_013978Cambridge id 5212522SMSF0004553STK550791AKOS005478027CB08132
Show more names
2-amino-3-(1-piperidinyl)naphthoquinone2-piperidino-3-amino-1,4-naphthoquinoneBIM-0013855.P001SR-01000198691SR-01000198691-1

Database identifiers

CAS
5212-52-2
PubChem CID
2833775
DTXSID
DTXSID40385368

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
63.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
19
Formal charge
0
Complexity
435

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

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