N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide

C16H11ClF3N3O — CID 125473568

IUPACN-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide
SMILESO=C(Cc1cccc2nccn12)Nc1ccc(C(F)(F)F)c(Cl)c1
InChIInChI=1S/C16H11ClF3N3O/c17-13-8-10(4-5-12(13)16(18,19)20)22-15(24)9-11-2-1-3-14-21-6-7-23(11)14/h1-8H,9H2,(H,22,24)
InChIKeyIYASGXPSTUCACO-UHFFFAOYSA-N
MW353.73 g/mol
LogP4.19
Rot. Bonds3

About N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide

N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide (PubChem CID 125473568) has the molecular formula C16H11ClF3N3O and a molecular weight of 353.73 g/mol. Its IUPAC name is N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide.

Molecular Properties

Compound NameN-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide
PubChem CID125473568
Molecular FormulaC16H11ClF3N3O
Molecular Weight353.73 g/mol
Exact Mass353.05
IUPAC NameN-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide
SMILESO=C(Cc1cccc2nccn12)Nc1ccc(C(F)(F)F)c(Cl)c1
InChIInChI=1S/C16H11ClF3N3O/c17-13-8-10(4-5-12(13)16(18,19)20)22-15(24)9-11-2-1-3-14-21-6-7-23(11)14/h1-8H,9H2,(H,22,24)
InChIKeyIYASGXPSTUCACO-UHFFFAOYSA-N
XLogP4.19
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.73
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide?
The IUPAC name of N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide (CID 125473568) is N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide.
What is the SMILES notation for N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide?
The canonical SMILES for N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide is O=C(Cc1cccc2nccn12)Nc1ccc(C(F)(F)F)c(Cl)c1.
What is the InChIKey of N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide?
The InChIKey is IYASGXPSTUCACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClF3N3O/c17-13-8-10(4-5-12(13)16(18,19)20)22-15(24)9-11-2-1-3-14-21-6-7-23(11)14/h1-8H,9H2,(H,22,24).
What are the key properties of N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide?
N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide has a molecular weight of 353.73 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide is sourced from PubChem (CID 125473568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).