4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine

C13H9ClFN3 — CID 14199155

IUPAC4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine
SMILESFc1ccccc1Cn1cnc2ccnc(Cl)c21
InChIInChI=1S/C13H9ClFN3/c14-13-12-11(5-6-16-13)17-8-18(12)7-9-3-1-2-4-10(9)15/h1-6,8H,7H2
InChIKeyFAPLCSDJHGMIMB-UHFFFAOYSA-N
MW261.69 g/mol
LogP3.27
Rot. Bonds2

About 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine

4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine (PubChem CID 14199155) has the molecular formula C13H9ClFN3 and a molecular weight of 261.69 g/mol. Its IUPAC name is 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine
PubChem CID14199155
Molecular FormulaC13H9ClFN3
Molecular Weight261.69 g/mol
Exact Mass261.05
IUPAC Name4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine
SMILESFc1ccccc1Cn1cnc2ccnc(Cl)c21
InChIInChI=1S/C13H9ClFN3/c14-13-12-11(5-6-16-13)17-8-18(12)7-9-3-1-2-4-10(9)15/h1-6,8H,7H2
InChIKeyFAPLCSDJHGMIMB-UHFFFAOYSA-N
XLogP3.27
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.69
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-chloro-1-[(2-fluorophenyl)methyl]pyrazin-2-one
CID 114561555
5,6-dichloro-3-[(2-fluorophenyl)methyl]pyrimidin-4-one
CID 114583259
6-chloro-3-[(2-fluorophenyl)methyl]pyrimidin-4-one
CID 114582406
6-chloro-3-[(2-fluorophenyl)methyl]-5-methoxypyrimidin-4-one
CID 114585464
N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine
CID 13264455
5-(chloromethyl)-1-[(2-fluorophenyl)methyl]imidazole
CID 18670887
1-[(2-chlorophenyl)methyl]-5,6-difluorobenzimidazole
CID 31788167
9-[(2-fluorophenyl)methyl]-N,N-dimethylpurin-2-amine
CID 54049040
3-[(2,4-difluorophenyl)methyl]-N-hydroxyimidazo[4,5-c]pyridine-4-carboxamide
CID 87747601
2-chloro-4-N-[(2-fluorophenyl)methyl]pyridine-3,4-diamine
CID 10399928
4-(chloromethyl)-1-[(2-fluorophenyl)methyl]imidazole
CID 106720825
7-[(2-fluorophenyl)methyl]-2-(methylaminomethyl)-1H-purin-6-one
CID 135708892

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine?
The IUPAC name of 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine (CID 14199155) is 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine.
What is the SMILES notation for 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine?
The canonical SMILES for 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine is Fc1ccccc1Cn1cnc2ccnc(Cl)c21.
What is the InChIKey of 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine?
The InChIKey is FAPLCSDJHGMIMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClFN3/c14-13-12-11(5-6-16-13)17-8-18(12)7-9-3-1-2-4-10(9)15/h1-6,8H,7H2.
What are the key properties of 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine?
4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine has a molecular weight of 261.69 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-[(2-fluorophenyl)methyl]imidazo[4,5-c]pyridine is sourced from PubChem (CID 14199155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).