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

C16H13ClFN3O — CID 25430229

IUPAC5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
SMILESO=C(NCCc1cn2ccccc2n1)c1cc(Cl)ccc1F
InChIInChI=1S/C16H13ClFN3O/c17-11-4-5-14(18)13(9-11)16(22)19-7-6-12-10-21-8-2-1-3-15(21)20-12/h1-5,8-10H,6-7H2,(H,19,22)
InChIKeyQBDGRWDFSGPQNQ-UHFFFAOYSA-N
MW317.75 g/mol
LogP3.10
Rot. Bonds4

About 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide

5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide (PubChem CID 25430229) has the molecular formula C16H13ClFN3O and a molecular weight of 317.75 g/mol. Its IUPAC name is 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
PubChem CID25430229
Molecular FormulaC16H13ClFN3O
Molecular Weight317.75 g/mol
Exact Mass317.07
IUPAC Name5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
SMILESO=C(NCCc1cn2ccccc2n1)c1cc(Cl)ccc1F
InChIInChI=1S/C16H13ClFN3O/c17-11-4-5-14(18)13(9-11)16(22)19-7-6-12-10-21-8-2-1-3-15(21)20-12/h1-5,8-10H,6-7H2,(H,19,22)
InChIKeyQBDGRWDFSGPQNQ-UHFFFAOYSA-N
XLogP3.10
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.75
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methyl-5-methylsulfanylbenzamide
CID 37275406
4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
CID 25429046
5-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methoxybenzamide
CID 32837177
2-chloro-N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]benzamide
CID 110671991
2,4-difluoro-N-[4-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-4-oxobutyl]benzamide
CID 32834586
5-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-fluorobenzamide
CID 86917632
2-benzoyl-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
CID 25430937
3-chloro-N-[2-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-2-oxoethyl]benzamide
CID 25429914
2-(2,4-dichlorophenoxy)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)acetamide
CID 25429007
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-nitrobenzamide
CID 25429006
N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-fluorobenzamide
CID 110671973
N-[2-(2,6-difluorophenyl)ethyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 87006920

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The IUPAC name of 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide (CID 25430229) is 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide.
What is the SMILES notation for 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The canonical SMILES for 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide is O=C(NCCc1cn2ccccc2n1)c1cc(Cl)ccc1F.
What is the InChIKey of 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The InChIKey is QBDGRWDFSGPQNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClFN3O/c17-11-4-5-14(18)13(9-11)16(22)19-7-6-12-10-21-8-2-1-3-15(21)20-12/h1-5,8-10H,6-7H2,(H,19,22).
What are the key properties of 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide has a molecular weight of 317.75 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 25430229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).