N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide

C15H12IN3O — CID 986158

IUPACN-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2cn3cc(I)ccc3n2)cc1
InChIInChI=1S/C15H12IN3O/c1-10(20)17-13-5-2-11(3-6-13)14-9-19-8-12(16)4-7-15(19)18-14/h2-9H,1H3,(H,17,20)
InChIKeyHOYSIAJXWAXMDV-UHFFFAOYSA-N
MW377.19 g/mol
LogP3.56
Rot. Bonds2

About N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide

N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide (PubChem CID 986158) has the molecular formula C15H12IN3O and a molecular weight of 377.19 g/mol. Its IUPAC name is N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
PubChem CID986158
Molecular FormulaC15H12IN3O
Molecular Weight377.19 g/mol
Exact Mass377.00
IUPAC NameN-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2cn3cc(I)ccc3n2)cc1
InChIInChI=1S/C15H12IN3O/c1-10(20)17-13-5-2-11(3-6-13)14-9-19-8-12(16)4-7-15(19)18-14/h2-9H,1H3,(H,17,20)
InChIKeyHOYSIAJXWAXMDV-UHFFFAOYSA-N
XLogP3.56
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.19
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide?
The IUPAC name of N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide (CID 986158) is N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide.
What is the SMILES notation for N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide?
The canonical SMILES for N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2cn3cc(I)ccc3n2)cc1.
What is the InChIKey of N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide?
The InChIKey is HOYSIAJXWAXMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12IN3O/c1-10(20)17-13-5-2-11(3-6-13)14-9-19-8-12(16)4-7-15(19)18-14/h2-9H,1H3,(H,17,20).
What are the key properties of N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide?
N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide has a molecular weight of 377.19 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-iodoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide is sourced from PubChem (CID 986158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).