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4-[[(Dimethylamino)methylene]amino]-3-pyridinol methylcarbamate

HCID 67749074
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CNC(=O)Oc1cnccc1N=CN(C)C
InChIKey
SZEMHIYFASTHLW-UHFFFAOYSA-N
Molecular formula
C10H14N4O2
Average molar mass
222.24 g/mol

Names & identifiers

Preferred name
4-[[(Dimethylamino)methylene]amino]-3-pyridinol methylcarbamate
IUPAC
[4-(dimethylaminomethylideneamino)-3-pyridinyl] N-methylcarbamate

Names & synonyms

SCHEMBL9017883SCHEMBL9017886SZEMHIYFASTHLW-UHFFFAOYSA-N4-[[(Dimethylamino)methylene]amino]-3-pyridinol methylcarbamate

Database identifiers

PubChem CID
67749074
Nikkaji
J482.616G

Properties

Computed structural properties

XLogP
0.1
Topological polar surface area
66.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
255

Related reactions

3 records
New reaction record
HRID 361331 reaction equation
HRID 361331As productuspto-grants-1999_02
HRID 362198 reaction equation
HRID 362198As productuspto-grants-1999_02
HRID 399391 reaction equation
HRID 399391As productuspto-grants-1998_10

Compound notes

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