4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine

C15H20N4O — CID 80769010

IUPAC4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine
SMILESCCOc1ccc(Nc2nc(C)nc(NC)c2C)cc1
InChIInChI=1S/C15H20N4O/c1-5-20-13-8-6-12(7-9-13)19-15-10(2)14(16-4)17-11(3)18-15/h6-9H,5H2,1-4H3,(H2,16,17,18,19)
InChIKeyWFNNWTOWGZNBTA-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.28
Rot. Bonds5

About 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine

4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine (PubChem CID 80769010) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine
PubChem CID80769010
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine
SMILESCCOc1ccc(Nc2nc(C)nc(NC)c2C)cc1
InChIInChI=1S/C15H20N4O/c1-5-20-13-8-6-12(7-9-13)19-15-10(2)14(16-4)17-11(3)18-15/h6-9H,5H2,1-4H3,(H2,16,17,18,19)
InChIKeyWFNNWTOWGZNBTA-UHFFFAOYSA-N
XLogP3.28
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-[4-(dimethylamino)phenyl]-6-N,2,5-trimethylpyrimidine-4,6-diamine
CID 80789763
1-N,4-N-bis(4-ethoxyphenyl)benzene-1,4-diamine
CID 139791472
N-(4-ethoxyphenyl)-3,6-dimethyl-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
CID 52998660
2,5-dimethyl-4-N-(4-propoxyphenyl)pyrimidine-4,6-diamine
CID 80825854
6-chloro-2-cyclopropyl-N-(4-ethoxyphenyl)-5-methylpyrimidin-4-amine
CID 80974062
4-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]benzonitrile
CID 80981793
4-N-(3-fluoro-4-methoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine
CID 80778681
5-(4-ethoxyanilino)-6-methyl-2H-1,2,4-triazin-3-one
CID 7213919
N-(4-ethoxyphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine
CID 80927038
6-N-(4-ethoxyphenyl)-4-N-(4-fluorophenyl)-2-methylpyrimidine-4,6-diamine
CID 112877881
6-N-ethyl-4-N-(4-fluorophenyl)-2,5-dimethylpyrimidine-4,6-diamine
CID 80761163
4-chloro-N-(4-ethoxyphenyl)-1,2,5-thiadiazol-3-amine
CID 43426956

Frequently Asked Questions

What is the IUPAC name of 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine (CID 80769010) is 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine is CCOc1ccc(Nc2nc(C)nc(NC)c2C)cc1.
What is the InChIKey of 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine?
The InChIKey is WFNNWTOWGZNBTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-5-20-13-8-6-12(7-9-13)19-15-10(2)14(16-4)17-11(3)18-15/h6-9H,5H2,1-4H3,(H2,16,17,18,19).
What are the key properties of 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine?
4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine has a molecular weight of 272.35 g/mol, XLogP of 3.28, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4-ethoxyphenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine is sourced from PubChem (CID 80769010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).