4-(3-naphthalen-1-ylphenyl)pyrimidine

C20H14N2 — CID 156551175

IUPAC4-(3-naphthalen-1-ylphenyl)pyrimidine
SMILESc1cc(-c2ccncn2)cc(-c2cccc3ccccc23)c1
InChIInChI=1S/C20H14N2/c1-2-9-18-15(5-1)6-4-10-19(18)16-7-3-8-17(13-16)20-11-12-21-14-22-20/h1-14H
InChIKeyDWTFIDDKAZUNCT-UHFFFAOYSA-N
MW282.35 g/mol
LogP4.96
Rot. Bonds2

About 4-(3-naphthalen-1-ylphenyl)pyrimidine

4-(3-naphthalen-1-ylphenyl)pyrimidine (PubChem CID 156551175) has the molecular formula C20H14N2 and a molecular weight of 282.35 g/mol. Its IUPAC name is 4-(3-naphthalen-1-ylphenyl)pyrimidine.

Molecular Properties

Compound Name4-(3-naphthalen-1-ylphenyl)pyrimidine
PubChem CID156551175
Molecular FormulaC20H14N2
Molecular Weight282.35 g/mol
Exact Mass282.12
IUPAC Name4-(3-naphthalen-1-ylphenyl)pyrimidine
SMILESc1cc(-c2ccncn2)cc(-c2cccc3ccccc23)c1
InChIInChI=1S/C20H14N2/c1-2-9-18-15(5-1)6-4-10-19(18)16-7-3-8-17(13-16)20-11-12-21-14-22-20/h1-14H
InChIKeyDWTFIDDKAZUNCT-UHFFFAOYSA-N
XLogP4.96
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-naphthalen-1-yl-5-(3-pyrimidin-4-ylphenyl)phenyl]-4,6-diphenylpyrimidine
CID 129292712
4-[3-(2-methylphenyl)phenyl]pyrimidine
CID 146397292
4-(3-pyridin-2-ylphenyl)pyrimidine
CID 172541875
2,6-bis(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)phenyl]pyridine
CID 118901430
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123841203
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
4-(2-phenyl-4-pyridinyl)pyrimidine
CID 58421020
2-naphthalen-1-yl-4-[3-[4-(4-phenylnaphthalen-1-yl)naphthalen-1-yl]phenyl]pyridine
CID 163947785
2-naphthalen-1-yl-4-(3-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130465785
4-(3-naphthalen-1-ylphenyl)-2-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 121477404
2-(3-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)-6-(4-pyridin-3-ylphenyl)pyridine
CID 134320914
2-(2-methylphenyl)-4,6-bis(3-naphthalen-1-ylphenyl)pyrimidine
CID 123694324

Frequently Asked Questions

What is the IUPAC name of 4-(3-naphthalen-1-ylphenyl)pyrimidine?
The IUPAC name of 4-(3-naphthalen-1-ylphenyl)pyrimidine (CID 156551175) is 4-(3-naphthalen-1-ylphenyl)pyrimidine.
What is the SMILES notation for 4-(3-naphthalen-1-ylphenyl)pyrimidine?
The canonical SMILES for 4-(3-naphthalen-1-ylphenyl)pyrimidine is c1cc(-c2ccncn2)cc(-c2cccc3ccccc23)c1.
What is the InChIKey of 4-(3-naphthalen-1-ylphenyl)pyrimidine?
The InChIKey is DWTFIDDKAZUNCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2/c1-2-9-18-15(5-1)6-4-10-19(18)16-7-3-8-17(13-16)20-11-12-21-14-22-20/h1-14H.
What are the key properties of 4-(3-naphthalen-1-ylphenyl)pyrimidine?
4-(3-naphthalen-1-ylphenyl)pyrimidine has a molecular weight of 282.35 g/mol, XLogP of 4.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-naphthalen-1-ylphenyl)pyrimidine is sourced from PubChem (CID 156551175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).