(3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone

C20H20FN5O2 — CID 23110123

IUPAC(3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone
SMILESCOc1ccc(-c2nc(C(=O)N3CCCC(F)C3)cn2-c2ccccn2)cn1
InChIInChI=1S/C20H20FN5O2/c1-28-18-8-7-14(11-23-18)19-24-16(13-26(19)17-6-2-3-9-22-17)20(27)25-10-4-5-15(21)12-25/h2-3,6-9,11,13,15H,4-5,10,12H2,1H3
InChIKeySGGSRJRFEFJQPH-UHFFFAOYSA-N
MW381.41 g/mol
LogP2.91
Rot. Bonds4

About (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone

(3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone (PubChem CID 23110123) has the molecular formula C20H20FN5O2 and a molecular weight of 381.41 g/mol. Its IUPAC name is (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone.

Molecular Properties

Compound Name(3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone
PubChem CID23110123
Molecular FormulaC20H20FN5O2
Molecular Weight381.41 g/mol
Exact Mass381.16
IUPAC Name(3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone
SMILESCOc1ccc(-c2nc(C(=O)N3CCCC(F)C3)cn2-c2ccccn2)cn1
InChIInChI=1S/C20H20FN5O2/c1-28-18-8-7-14(11-23-18)19-24-16(13-26(19)17-6-2-3-9-22-17)20(27)25-10-4-5-15(21)12-25/h2-3,6-9,11,13,15H,4-5,10,12H2,1H3
InChIKeySGGSRJRFEFJQPH-UHFFFAOYSA-N
XLogP2.91
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.41
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone with MolForge

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Related Compounds

[(3R)-3-fluoropiperidin-1-yl]-[1-(6-methoxy-3-pyridinyl)-5-pyridin-2-ylpyrazol-3-yl]methanone
CID 59003558
4-[2-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)imidazole-4-carbonyl]-1-methylpiperazin-2-one
CID 23110194
[2-(6-methoxy-3-pyridinyl)-1-phenylimidazol-4-yl]-(2,2,4-trimethylpiperazin-1-yl)methanone
CID 23110210
(6-methoxy-3-pyridinyl)-(3-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 46975635
[(3S)-3-aminopiperidin-1-yl]-(6-methoxy-3-pyridinyl)methanone
CID 129493895
[1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 23090210
3-[1-(4-methoxybenzoyl)piperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one
CID 24817468
(3-fluoropiperidin-1-yl)-phenylmethanone
CID 167717341
[3-(4,6-dimethylpyrimidin-2-yl)oxypiperidin-1-yl]-pyridin-2-ylmethanone
CID 122257904
[3-(2-methylpyrimidin-4-yl)oxypiperidin-1-yl]-pyridin-2-ylmethanone
CID 122260869
(6-methoxypyridazin-3-yl)-[4-[methyl(pyridin-2-ylmethyl)amino]azepan-1-yl]methanone
CID 128996392
[6-(6-methoxy-3-pyridinyl)-3-pyridinyl]-[(4R)-4-phenylazepan-1-yl]methanone
CID 95218046

Frequently Asked Questions

What is the IUPAC name of (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone?
The IUPAC name of (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone (CID 23110123) is (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone.
What is the SMILES notation for (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone?
The canonical SMILES for (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone is COc1ccc(-c2nc(C(=O)N3CCCC(F)C3)cn2-c2ccccn2)cn1.
What is the InChIKey of (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone?
The InChIKey is SGGSRJRFEFJQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN5O2/c1-28-18-8-7-14(11-23-18)19-24-16(13-26(19)17-6-2-3-9-22-17)20(27)25-10-4-5-15(21)12-25/h2-3,6-9,11,13,15H,4-5,10,12H2,1H3.
What are the key properties of (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone?
(3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone has a molecular weight of 381.41 g/mol, XLogP of 2.91, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone is sourced from PubChem (CID 23110123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).