4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine

C19H18ClFN6 — CID 20812037

IUPAC4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine
SMILESCCCn1c(Cn2ccnc2-c2cccc(F)n2)nc2c(Cl)nc(C)cc21
InChIInChI=1S/C19H18ClFN6/c1-3-8-27-14-10-12(2)23-18(20)17(14)25-16(27)11-26-9-7-22-19(26)13-5-4-6-15(21)24-13/h4-7,9-10H,3,8,11H2,1-2H3
InChIKeyOJVDHCJTTPDLSL-UHFFFAOYSA-N
MW384.85 g/mol
LogP4.25
Rot. Bonds5

About 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine

4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine (PubChem CID 20812037) has the molecular formula C19H18ClFN6 and a molecular weight of 384.85 g/mol. Its IUPAC name is 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine
PubChem CID20812037
Molecular FormulaC19H18ClFN6
Molecular Weight384.85 g/mol
Exact Mass384.13
IUPAC Name4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine
SMILESCCCn1c(Cn2ccnc2-c2cccc(F)n2)nc2c(Cl)nc(C)cc21
InChIInChI=1S/C19H18ClFN6/c1-3-8-27-14-10-12(2)23-18(20)17(14)25-16(27)11-26-9-7-22-19(26)13-5-4-6-15(21)24-13/h4-7,9-10H,3,8,11H2,1-2H3
InChIKeyOJVDHCJTTPDLSL-UHFFFAOYSA-N
XLogP4.25
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.85
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine?
The IUPAC name of 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine (CID 20812037) is 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine.
What is the SMILES notation for 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine?
The canonical SMILES for 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine is CCCn1c(Cn2ccnc2-c2cccc(F)n2)nc2c(Cl)nc(C)cc21.
What is the InChIKey of 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine?
The InChIKey is OJVDHCJTTPDLSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClFN6/c1-3-8-27-14-10-12(2)23-18(20)17(14)25-16(27)11-26-9-7-22-19(26)13-5-4-6-15(21)24-13/h4-7,9-10H,3,8,11H2,1-2H3.
What are the key properties of 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine?
4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine has a molecular weight of 384.85 g/mol, XLogP of 4.25, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-methyl-1-propylimidazo[4,5-c]pyridine is sourced from PubChem (CID 20812037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).