4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide

C16H14FN3O — CID 25429046

IUPAC4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
SMILESO=C(NCCc1cn2ccccc2n1)c1ccc(F)cc1
InChIInChI=1S/C16H14FN3O/c17-13-6-4-12(5-7-13)16(21)18-9-8-14-11-20-10-2-1-3-15(20)19-14/h1-7,10-11H,8-9H2,(H,18,21)
InChIKeyUCXYJBDQSQVHAY-UHFFFAOYSA-N
MW283.31 g/mol
LogP2.45
Rot. Bonds4

About 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide

4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide (PubChem CID 25429046) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
PubChem CID25429046
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC Name4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
SMILESO=C(NCCc1cn2ccccc2n1)c1ccc(F)cc1
InChIInChI=1S/C16H14FN3O/c17-13-6-4-12(5-7-13)16(21)18-9-8-14-11-20-10-2-1-3-15(20)19-14/h1-7,10-11H,8-9H2,(H,18,21)
InChIKeyUCXYJBDQSQVHAY-UHFFFAOYSA-N
XLogP2.45
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The IUPAC name of 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide (CID 25429046) is 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The canonical SMILES for 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide is O=C(NCCc1cn2ccccc2n1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The InChIKey is UCXYJBDQSQVHAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c17-13-6-4-12(5-7-13)16(21)18-9-8-14-11-20-10-2-1-3-15(20)19-14/h1-7,10-11H,8-9H2,(H,18,21).
What are the key properties of 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide has a molecular weight of 283.31 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 25429046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).