6-chloro-N-(2-methylphenyl)pyrimidine-4-carboxamide

HCID 59447093
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccccc1NC(=O)c1cc(Cl)ncn1
InChIKey
UGGSERWVRXUNKW-UHFFFAOYSA-N
Molecular formula
C12H10ClN3O
Average molar mass
247.68 g/mol
Monoisotopic mass
247.0512396

Names & identifiers

Preferred name
6-chloro-N-(2-methylphenyl)pyrimidine-4-carboxamide
IUPAC
6-chloro-N-(2-methylphenyl)pyrimidine-4-carboxamide

Names & synonyms

SCHEMBL2773696UGGSERWVRXUNKW-UHFFFAOYSA-N6-chloro-N-(2-methylphenyl)pyrimidine-4-carboxamide

Database identifiers

PubChem CID
59447093

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
54.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17

Related reactions

8 records
New reaction record

Linked notes

Loading…