6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine

C18H17N3 — CID 115915041

IUPAC6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine
SMILESCc1cc(C)cc(-c2cc(N)nc(-c3ccccc3)n2)c1
InChIInChI=1S/C18H17N3/c1-12-8-13(2)10-15(9-12)16-11-17(19)21-18(20-16)14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,19,20,21)
InChIKeyCZAQFRGSAAXRIB-UHFFFAOYSA-N
MW275.35 g/mol
LogP4.01
Rot. Bonds2

About 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine

6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine (PubChem CID 115915041) has the molecular formula C18H17N3 and a molecular weight of 275.35 g/mol. Its IUPAC name is 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine
PubChem CID115915041
Molecular FormulaC18H17N3
Molecular Weight275.35 g/mol
Exact Mass275.14
IUPAC Name6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine
SMILESCc1cc(C)cc(-c2cc(N)nc(-c3ccccc3)n2)c1
InChIInChI=1S/C18H17N3/c1-12-8-13(2)10-15(9-12)16-11-17(19)21-18(20-16)14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,19,20,21)
InChIKeyCZAQFRGSAAXRIB-UHFFFAOYSA-N
XLogP4.01
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-6-(3-phenylphenyl)pyrimidin-4-amine
CID 138714829
6-(5-methylthiophen-2-yl)-2-phenylpyrimidin-4-amine
CID 112559736
4-(3,5-dimethylphenyl)-2,6-diphenylpyridine
CID 132529641
2-(3-chloro-4-methylphenyl)-6-phenylpyrimidin-4-amine
CID 106818359
4-[3-(3,5-dimethylphenyl)phenyl]-2-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-6-phenylpyrimidine
CID 59552862
4-[2-(4-aminophenyl)-6-phenylpyrimidin-4-yl]aniline
CID 630837
4-(4,6-diphenylpyrimidin-2-yl)aniline
CID 629613
ethane;4-(3-methylphenyl)-2,6-diphenylpyrimidine
CID 144569166
2-(3-fluorophenyl)-6-phenylpyrimidin-4-amine
CID 62192602
4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine
CID 63866847
4-[3-(2,6-diphenyl-4-pyridinyl)-5-(2,6-diphenylpyrimidin-4-yl)phenyl]-6-(4-methylphenyl)-2-phenylpyrimidine
CID 135243270
2-[3-(3-methylphenyl)phenyl]-4,6-diphenylpyrimidine
CID 121315996

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine?
The IUPAC name of 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine (CID 115915041) is 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine.
What is the SMILES notation for 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine?
The canonical SMILES for 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine is Cc1cc(C)cc(-c2cc(N)nc(-c3ccccc3)n2)c1.
What is the InChIKey of 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine?
The InChIKey is CZAQFRGSAAXRIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-12-8-13(2)10-15(9-12)16-11-17(19)21-18(20-16)14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,19,20,21).
What are the key properties of 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine?
6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine has a molecular weight of 275.35 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethylphenyl)-2-phenylpyrimidin-4-amine is sourced from PubChem (CID 115915041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).