2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine

C18H12FN5 — CID 59252465

IUPAC2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine
SMILESFc1cccc(-c2ncc(-c3cnc(-c4cccnc4)[nH]3)cn2)c1
InChIInChI=1S/C18H12FN5/c19-15-5-1-3-12(7-15)17-21-9-14(10-22-17)16-11-23-18(24-16)13-4-2-6-20-8-13/h1-11H,(H,23,24)
InChIKeyATIJGZNOVFHFBW-UHFFFAOYSA-N
MW317.33 g/mol
LogP3.73
Rot. Bonds3

About 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine

2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine (PubChem CID 59252465) has the molecular formula C18H12FN5 and a molecular weight of 317.33 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine
PubChem CID59252465
Molecular FormulaC18H12FN5
Molecular Weight317.33 g/mol
Exact Mass317.11
IUPAC Name2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine
SMILESFc1cccc(-c2ncc(-c3cnc(-c4cccnc4)[nH]3)cn2)c1
InChIInChI=1S/C18H12FN5/c19-15-5-1-3-12(7-15)17-21-9-14(10-22-17)16-11-23-18(24-16)13-4-2-6-20-8-13/h1-11H,(H,23,24)
InChIKeyATIJGZNOVFHFBW-UHFFFAOYSA-N
XLogP3.73
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.33
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Mavorixafor
CID 11256587
Toreforant
CID 23650961
Vactosertib
CID 54766013
N2-((1S)-1-(4-Fluorophenyl)ethyl)-4-(1-methyl-1H-pyrazol-4-yl)-N6-2-pyrazinyl-2,6-pyridinediamine
CID 46866319
2,2'-Di-4-pyridinyl-5,5'-bi-1H-benzimidazole
CID 16659285
SB-220025
CID 5164
2-((4-pyridin-2-ylpiperazine-1-yl)methyl)-1H-benzimidazole
CID 5025739
2-(pyridin-3-yl)-1H-1,3-benzodiazole
CID 247635
PF-4708671
CID 51371303
PF-670462
CID 51049607
(alphaS)-7-Fluoro-alpha-methyl-N-9H-purin-6-yl-2-(2-pyridinyl)-3-quinolinemethanamine
CID 68947304
2-(3-Trifluoromethylphenyl)histamine
CID 5310982

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine?
The IUPAC name of 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine (CID 59252465) is 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine.
What is the SMILES notation for 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine?
The canonical SMILES for 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine is Fc1cccc(-c2ncc(-c3cnc(-c4cccnc4)[nH]3)cn2)c1.
What is the InChIKey of 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine?
The InChIKey is ATIJGZNOVFHFBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN5/c19-15-5-1-3-12(7-15)17-21-9-14(10-22-17)16-11-23-18(24-16)13-4-2-6-20-8-13/h1-11H,(H,23,24).
What are the key properties of 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine?
2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine has a molecular weight of 317.33 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-5-(2-pyridin-3-yl-1H-imidazol-5-yl)pyrimidine is sourced from PubChem (CID 59252465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).