5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine

C19H15FN4 — CID 70746819

IUPAC5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine
SMILESFCCn1ccnc1-c1cnc(-c2cccc3ccccc23)nc1
InChIInChI=1S/C19H15FN4/c20-8-10-24-11-9-21-19(24)15-12-22-18(23-13-15)17-7-3-5-14-4-1-2-6-16(14)17/h1-7,9,11-13H,8,10H2
InChIKeyPQCIQVIKIOCOLO-UHFFFAOYSA-N
MW318.36 g/mol
LogP4.13
Rot. Bonds4

About 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine

5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine (PubChem CID 70746819) has the molecular formula C19H15FN4 and a molecular weight of 318.36 g/mol. Its IUPAC name is 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine.

Molecular Properties

Compound Name5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine
PubChem CID70746819
Molecular FormulaC19H15FN4
Molecular Weight318.36 g/mol
Exact Mass318.13
IUPAC Name5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine
SMILESFCCn1ccnc1-c1cnc(-c2cccc3ccccc23)nc1
InChIInChI=1S/C19H15FN4/c20-8-10-24-11-9-21-19(24)15-12-22-18(23-13-15)17-7-3-5-14-4-1-2-6-16(14)17/h1-7,9,11-13H,8,10H2
InChIKeyPQCIQVIKIOCOLO-UHFFFAOYSA-N
XLogP4.13
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.36
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-4-[2-[2-(2-methylphenyl)pyrimidin-5-yl]imidazol-1-yl]butan-2-ol
CID 155494598
3-[2-(2-fluorophenyl)imidazol-1-yl]propan-1-amine
CID 82559058
2-naphthalen-1-yl-5-propan-2-ylpyrimidine
CID 176640404
2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol
CID 56740009
1-ethenyl-2-naphthalen-1-ylimidazole
CID 174900628
2,4-dinaphthalen-1-yl-6-(4-pyrimidin-2-ylphenyl)-1,3,5-triazine
CID 122426450
1-but-3-ynyl-2-phenylimidazole
CID 55249657
2-[2-[2-(4-methoxyphenyl)pyrimidin-5-yl]imidazol-1-yl]-N,N-dimethylethanamine
CID 56745738
5-[1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-yl]isoquinoline
CID 146039872
1-(3-bromopropyl)-2-phenylimidazole
CID 61069567
1-naphthalen-1-ylnaphthalene;ruthenium(2+);dichloride
CID 11327769
2-(5-pyrimidin-2-ylnaphthalen-1-yl)pyrimidine
CID 169050093

Frequently Asked Questions

What is the IUPAC name of 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine?
The IUPAC name of 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine (CID 70746819) is 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine.
What is the SMILES notation for 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine?
The canonical SMILES for 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine is FCCn1ccnc1-c1cnc(-c2cccc3ccccc23)nc1.
What is the InChIKey of 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine?
The InChIKey is PQCIQVIKIOCOLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4/c20-8-10-24-11-9-21-19(24)15-12-22-18(23-13-15)17-7-3-5-14-4-1-2-6-16(14)17/h1-7,9,11-13H,8,10H2.
What are the key properties of 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine?
5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine has a molecular weight of 318.36 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2-fluoroethyl)imidazol-2-yl]-2-naphthalen-1-ylpyrimidine is sourced from PubChem (CID 70746819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).