2,4-Diamino-5-methylpyrimidine

HCID 65266

Basic information

CAS
18588-37-9
Standard SMILES
Cc1cnc(N)nc1N
InChIKey
RXYIYUOOCZCTQP-UHFFFAOYSA-N
Molecular formula
C5H8N4
Average molar mass
124.14 g/mol
Monoisotopic mass
124.07489626

Overview

antifolate drug; structure given in first source

Names & identifiers

Preferred name
2,4-Diamino-5-methylpyrimidine
IUPAC
5-methylpyrimidine-2,4-diamine
English name
2,4-Pyrimidinediamine, 5-methyl- (9CI)
Molecular formula
C5H8N4
Molecular weight
124.14

Names & synonyms

18588-37-92,4-Diamino-5-methylpyrimidineDam-pyr2,4-Pyrimidinediamine, 5-methyl-DTXSID40171804RefChem:82253DTXCID40942955-methylpyrimidine-2,4-diamine2,4-Pyrimidinediamine, 5-methyl- (9CI)5-methylcytosine imineSCHEMBL879562methyl-2,4-pyrimidine-diamine
Show more names
SCHEMBL7123667SCHEMBL31656490RXYIYUOOCZCTQP-UHFFFAOYSA-Npyrimidine, 2,4-diamino-5-methyl-AKOS006341749

Database identifiers

CAS
18588-37-9
PubChem CID
65266
DTXSID
DTXSID40171804
Nikkaji
J2.424.359A

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
77.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
9

Chemistry & industry

Suppliers1 total

Related reactions

9 records

Compound notes

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