N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide

C16H12Cl3N3O2 — CID 8917219

IUPACN-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide
SMILESO=C(COc1cc(Cl)c(Cl)cc1Cl)NCc1cn2ccccc2n1
InChIInChI=1S/C16H12Cl3N3O2/c17-11-5-13(19)14(6-12(11)18)24-9-16(23)20-7-10-8-22-4-2-1-3-15(22)21-10/h1-6,8H,7,9H2,(H,20,23)
InChIKeySXGHOYQUUXHVAG-UHFFFAOYSA-N
MW384.65 g/mol
LogP3.99
Rot. Bonds5

About N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide (PubChem CID 8917219) has the molecular formula C16H12Cl3N3O2 and a molecular weight of 384.65 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide
PubChem CID8917219
Molecular FormulaC16H12Cl3N3O2
Molecular Weight384.65 g/mol
Exact Mass383.00
IUPAC NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide
SMILESO=C(COc1cc(Cl)c(Cl)cc1Cl)NCc1cn2ccccc2n1
InChIInChI=1S/C16H12Cl3N3O2/c17-11-5-13(19)14(6-12(11)18)24-9-16(23)20-7-10-8-22-4-2-1-3-15(22)21-10/h1-6,8H,7,9H2,(H,20,23)
InChIKeySXGHOYQUUXHVAG-UHFFFAOYSA-N
XLogP3.99
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.65
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

2-(4-chlorophenoxy)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide
CID 8917153
2-(2,4-dichlorophenoxy)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)acetamide
CID 25429007
N'-(3-chlorophenyl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propanediamide
CID 166517595
3,4,5-triethoxy-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
CID 8917080
N-[2-(2-chlorophenoxy)ethyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide
CID 74243702
2-(2,4-dichlorophenoxy)-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)acetamide
CID 90569546
4,5-dichloro-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)aniline
CID 107497897
2-(4-ethoxyphenoxy)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)acetamide
CID 42017579
2-N,6-N-bis(imidazo[1,2-a]pyridin-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 43063902
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methoxynaphthalene-2-carboxamide
CID 17397246
2-[(2-chloro-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
CID 170746842
2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine
CID 112779233

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
The IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide (CID 8917219) is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide is O=C(COc1cc(Cl)c(Cl)cc1Cl)NCc1cn2ccccc2n1.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
The InChIKey is SXGHOYQUUXHVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl3N3O2/c17-11-5-13(19)14(6-12(11)18)24-9-16(23)20-7-10-8-22-4-2-1-3-15(22)21-10/h1-6,8H,7,9H2,(H,20,23).
What are the key properties of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide has a molecular weight of 384.65 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2,4,5-trichlorophenoxy)acetamide is sourced from PubChem (CID 8917219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).