(6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone

C18H15BrClFN4O — CID 166359121

IUPAC(6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone
SMILESO=C(c1nc2ccc(Br)cn2c1F)N1CCC(c2ccc(Cl)cn2)CC1
InChIInChI=1S/C18H15BrClFN4O/c19-12-1-4-15-23-16(17(21)25(15)10-12)18(26)24-7-5-11(6-8-24)14-3-2-13(20)9-22-14/h1-4,9-11H,5-8H2
InChIKeyCHLVSLDAELMNKG-UHFFFAOYSA-N
MW437.70 g/mol
LogP4.30
Rot. Bonds2

About (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone

(6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone (PubChem CID 166359121) has the molecular formula C18H15BrClFN4O and a molecular weight of 437.70 g/mol. Its IUPAC name is (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone
PubChem CID166359121
Molecular FormulaC18H15BrClFN4O
Molecular Weight437.70 g/mol
Exact Mass436.01
IUPAC Name(6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone
SMILESO=C(c1nc2ccc(Br)cn2c1F)N1CCC(c2ccc(Cl)cn2)CC1
InChIInChI=1S/C18H15BrClFN4O/c19-12-1-4-15-23-16(17(21)25(15)10-12)18(26)24-7-5-11(6-8-24)14-3-2-13(20)9-22-14/h1-4,9-11H,5-8H2
InChIKeyCHLVSLDAELMNKG-UHFFFAOYSA-N
XLogP4.30
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.70
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone?
The IUPAC name of (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone (CID 166359121) is (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone.
What is the SMILES notation for (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone?
The canonical SMILES for (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone is O=C(c1nc2ccc(Br)cn2c1F)N1CCC(c2ccc(Cl)cn2)CC1.
What is the InChIKey of (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone?
The InChIKey is CHLVSLDAELMNKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrClFN4O/c19-12-1-4-15-23-16(17(21)25(15)10-12)18(26)24-7-5-11(6-8-24)14-3-2-13(20)9-22-14/h1-4,9-11H,5-8H2.
What are the key properties of (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone?
(6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone has a molecular weight of 437.70 g/mol, XLogP of 4.30, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]methanone is sourced from PubChem (CID 166359121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).