2-phenyl-4-(2-phenylethyl)pyrimidine

C18H16N2 — CID 134958718

IUPAC2-phenyl-4-(2-phenylethyl)pyrimidine
SMILESc1ccc(CCc2ccnc(-c3ccccc3)n2)cc1
InChIInChI=1S/C18H16N2/c1-3-7-15(8-4-1)11-12-17-13-14-19-18(20-17)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2
InChIKeyGOXXUZGRTPWRLP-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.93
Rot. Bonds4

About 2-phenyl-4-(2-phenylethyl)pyrimidine

2-phenyl-4-(2-phenylethyl)pyrimidine (PubChem CID 134958718) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-phenyl-4-(2-phenylethyl)pyrimidine.

Molecular Properties

Compound Name2-phenyl-4-(2-phenylethyl)pyrimidine
PubChem CID134958718
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC Name2-phenyl-4-(2-phenylethyl)pyrimidine
SMILESc1ccc(CCc2ccnc(-c3ccccc3)n2)cc1
InChIInChI=1S/C18H16N2/c1-3-7-15(8-4-1)11-12-17-13-14-19-18(20-17)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2
InChIKeyGOXXUZGRTPWRLP-UHFFFAOYSA-N
XLogP3.93
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-diphenylpyrimidine;yttrium
CID 59738567
4-(imidazol-1-ylmethyl)-2-phenylpyrimidine
CID 131736320
[4-(2-phenylpyrimidin-4-yl)phenyl]methanamine;hydrochloride
CID 82021904
4-phenyl-2-(2-phenylethyl)pyrimidine
CID 150687160
N-[(2-phenylpyrimidin-4-yl)methyl]butan-1-amine
CID 46785106
2,4-bis(4-phenylphenyl)pyrimidine
CID 138636531
ethane;methyl 3-[4-[(2-phenylpyrimidin-4-yl)methoxy]phenyl]propanoate
CID 123182715
2-phenylpyrimidine
CID 593578
2,4-diphenylpyrimidine;triphenylene
CID 175536318
2-[6-(2-phenylethyl)-2-pyridinyl]ethanol
CID 117001687
2-[2-(4-bromophenyl)pyrimidin-4-yl]ethanamine
CID 62746440
benzene;2-phenylethylbenzene
CID 18982764

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-(2-phenylethyl)pyrimidine?
The IUPAC name of 2-phenyl-4-(2-phenylethyl)pyrimidine (CID 134958718) is 2-phenyl-4-(2-phenylethyl)pyrimidine.
What is the SMILES notation for 2-phenyl-4-(2-phenylethyl)pyrimidine?
The canonical SMILES for 2-phenyl-4-(2-phenylethyl)pyrimidine is c1ccc(CCc2ccnc(-c3ccccc3)n2)cc1.
What is the InChIKey of 2-phenyl-4-(2-phenylethyl)pyrimidine?
The InChIKey is GOXXUZGRTPWRLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2/c1-3-7-15(8-4-1)11-12-17-13-14-19-18(20-17)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2.
What are the key properties of 2-phenyl-4-(2-phenylethyl)pyrimidine?
2-phenyl-4-(2-phenylethyl)pyrimidine has a molecular weight of 260.34 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-(2-phenylethyl)pyrimidine is sourced from PubChem (CID 134958718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).