1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone

C14H9ClFN3O — CID 164536549

IUPAC1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone
SMILESCC(=O)c1cc(-c2cc(F)c3nccn3c2)c(Cl)cn1
InChIInChI=1S/C14H9ClFN3O/c1-8(20)13-5-10(11(15)6-18-13)9-4-12(16)14-17-2-3-19(14)7-9/h2-7H,1H3
InChIKeyPNRPTCDFTCFAHI-UHFFFAOYSA-N
MW289.70 g/mol
LogP3.39
Rot. Bonds2

About 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone

1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone (PubChem CID 164536549) has the molecular formula C14H9ClFN3O and a molecular weight of 289.70 g/mol. Its IUPAC name is 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone.

Molecular Properties

Compound Name1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone
PubChem CID164536549
Molecular FormulaC14H9ClFN3O
Molecular Weight289.70 g/mol
Exact Mass289.04
IUPAC Name1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone
SMILESCC(=O)c1cc(-c2cc(F)c3nccn3c2)c(Cl)cn1
InChIInChI=1S/C14H9ClFN3O/c1-8(20)13-5-10(11(15)6-18-13)9-4-12(16)14-17-2-3-19(14)7-9/h2-7H,1H3
InChIKeyPNRPTCDFTCFAHI-UHFFFAOYSA-N
XLogP3.39
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.70
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone?
The IUPAC name of 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone (CID 164536549) is 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone.
What is the SMILES notation for 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone?
The canonical SMILES for 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone is CC(=O)c1cc(-c2cc(F)c3nccn3c2)c(Cl)cn1.
What is the InChIKey of 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone?
The InChIKey is PNRPTCDFTCFAHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClFN3O/c1-8(20)13-5-10(11(15)6-18-13)9-4-12(16)14-17-2-3-19(14)7-9/h2-7H,1H3.
What are the key properties of 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone?
1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone has a molecular weight of 289.70 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone is sourced from PubChem (CID 164536549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).