3-[4-(6-Chloropyridin-3-yl)pyrimidin-2-ylamino]-4-methylaniline

HCID 58774827
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Basic information

Standard SMILES
Cc1ccc(N)cc1Nc1nccc(-c2ccc(Cl)nc2)n1
InChIKey
VURBEDYRWZHJTB-UHFFFAOYSA-N
Molecular formula
C16H14ClN5
Average molar mass
311.77 g/mol
Monoisotopic mass
311.0937732

Names & identifiers

Preferred name
3-[4-(6-Chloropyridin-3-yl)pyrimidin-2-ylamino]-4-methylaniline
IUPAC
3-N-[4-(6-chloro-3-pyridinyl)pyrimidin-2-yl]-4-methylbenzene-1,3-diamine

Names & synonyms

3-[4-(6-chloropyridin-3-yl)pyrimidin-2-ylamino]-4-methylaniline641615-40-9SCHEMBL4262471DB-331009

Database identifiers

PubChem CID
58774827

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
76.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
22

Related reactions

12 records
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Compound notes

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