5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine

C14H17N3 — CID 82288023

IUPAC5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine
SMILESCc1ccc(C)c(-c2c(C)nc(C)nc2N)c1
InChIInChI=1S/C14H17N3/c1-8-5-6-9(2)12(7-8)13-10(3)16-11(4)17-14(13)15/h5-7H,1-4H3,(H2,15,16,17)
InChIKeyRILHDIBWHCPOGE-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.96
Rot. Bonds1

About 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine

5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine (PubChem CID 82288023) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine
PubChem CID82288023
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine
SMILESCc1ccc(C)c(-c2c(C)nc(C)nc2N)c1
InChIInChI=1S/C14H17N3/c1-8-5-6-9(2)12(7-8)13-10(3)16-11(4)17-14(13)15/h5-7H,1-4H3,(H2,15,16,17)
InChIKeyRILHDIBWHCPOGE-UHFFFAOYSA-N
XLogP2.96
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-methoxy-5-propan-2-ylphenyl)-2,6-dimethylpyrimidin-4-amine
CID 95474423
5-(2,5-dimethoxyphenyl)-2,6-dimethylpyrimidin-4-amine
CID 82301068
2-(2,5-dimethylphenyl)-6-methylquinazolin-4-amine
CID 64983731
[4-(2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
CID 82473895
2,7-dimethylquinazolin-4-amine
CID 59095817
4-N-(2,5-dimethylphenyl)-2,5-dimethylpyrimidine-4,6-diamine
CID 80763496
5-(2,4-dimethylphenyl)-2-methylpyrimidin-4-amine
CID 82284415
4-(2,5-dimethylphenyl)-5-methyl-1,3-thiazol-2-amine
CID 842777
2-amino-4-(2,5-dimethylphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 4635452
2-tert-butyl-6-(2,5-dimethylphenyl)-5-methylpyrimidin-4-amine
CID 80975360
5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine
CID 15280859
2-amino-4,6-bis(2,5-dimethylphenyl)pyridine-3-carbonitrile
CID 3513608

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine?
The IUPAC name of 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine (CID 82288023) is 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine.
What is the SMILES notation for 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine?
The canonical SMILES for 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine is Cc1ccc(C)c(-c2c(C)nc(C)nc2N)c1.
What is the InChIKey of 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine?
The InChIKey is RILHDIBWHCPOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-8-5-6-9(2)12(7-8)13-10(3)16-11(4)17-14(13)15/h5-7H,1-4H3,(H2,15,16,17).
What are the key properties of 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine?
5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine has a molecular weight of 227.31 g/mol, XLogP of 2.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine is sourced from PubChem (CID 82288023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).