5-(4-methylphenyl)-2-phenylpyrimidin-4-amine

C17H15N3 — CID 62900567

IUPAC5-(4-methylphenyl)-2-phenylpyrimidin-4-amine
SMILESCc1ccc(-c2cnc(-c3ccccc3)nc2N)cc1
InChIInChI=1S/C17H15N3/c1-12-7-9-13(10-8-12)15-11-19-17(20-16(15)18)14-5-3-2-4-6-14/h2-11H,1H3,(H2,18,19,20)
InChIKeyINDVXJQHURGGAN-UHFFFAOYSA-N
MW261.33 g/mol
LogP3.70
Rot. Bonds2

About 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine

5-(4-methylphenyl)-2-phenylpyrimidin-4-amine (PubChem CID 62900567) has the molecular formula C17H15N3 and a molecular weight of 261.33 g/mol. Its IUPAC name is 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine.

Molecular Properties

Compound Name5-(4-methylphenyl)-2-phenylpyrimidin-4-amine
PubChem CID62900567
Molecular FormulaC17H15N3
Molecular Weight261.33 g/mol
Exact Mass261.13
IUPAC Name5-(4-methylphenyl)-2-phenylpyrimidin-4-amine
SMILESCc1ccc(-c2cnc(-c3ccccc3)nc2N)cc1
InChIInChI=1S/C17H15N3/c1-12-7-9-13(10-8-12)15-11-19-17(20-16(15)18)14-5-3-2-4-6-14/h2-11H,1H3,(H2,18,19,20)
InChIKeyINDVXJQHURGGAN-UHFFFAOYSA-N
XLogP3.70
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-[4-methyl-2-[4-methyl-2-(4-methyl-2-phenylpyrimidin-5-yl)pyrimidin-5-yl]pyrimidin-5-yl]-5-phenylpyrimidine
CID 58281695
5-(4-methylphenyl)-2-[4-(2-phenylpyrimidin-5-yl)phenyl]pyrimidine
CID 21044112
2-ethyl-5-phenylpyrimidin-4-amine
CID 62900948
7-methyl-2-phenylquinazoline
CID 102363369
2-phenyl-4-(2-phenylphenyl)-5-[2-phenyl-4-(2-phenylphenyl)pyrimidin-5-yl]pyrimidine
CID 58947716
5-(bromomethyl)-2-phenylpyrimidin-4-amine
CID 91165932
5-methyl-2-(5-methylpyrimidin-2-yl)-6-phenylpyrimidin-4-amine
CID 104846665
4-methyl-3-(4-methylphenyl)quinoline
CID 59375945
2-[4-[8-[4-(4-methylphenyl)phenyl]-9H-fluoren-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 134509781
2-methyl-5-(3-methylphenyl)pyrimidin-4-amine
CID 62899429
5-(2-phenylphenyl)-2-[4-[5-(2-phenylphenyl)pyrimidin-2-yl]phenyl]pyrimidine
CID 140968105
4-(4-methyl-2-phenylpyrimidin-5-yl)-2,6-diphenylpyrimidine
CID 12537657

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine?
The IUPAC name of 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine (CID 62900567) is 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine.
What is the SMILES notation for 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine?
The canonical SMILES for 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine is Cc1ccc(-c2cnc(-c3ccccc3)nc2N)cc1.
What is the InChIKey of 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine?
The InChIKey is INDVXJQHURGGAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3/c1-12-7-9-13(10-8-12)15-11-19-17(20-16(15)18)14-5-3-2-4-6-14/h2-11H,1H3,(H2,18,19,20).
What are the key properties of 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine?
5-(4-methylphenyl)-2-phenylpyrimidin-4-amine has a molecular weight of 261.33 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-2-phenylpyrimidin-4-amine is sourced from PubChem (CID 62900567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).