3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine

C15H11Cl3N2 — CID 82029766

IUPAC3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine
SMILESCC(Cl)c1c(-c2ccc(Cl)cc2Cl)nc2ccccn12
InChIInChI=1S/C15H11Cl3N2/c1-9(16)15-14(11-6-5-10(17)8-12(11)18)19-13-4-2-3-7-20(13)15/h2-9H,1H3
InChIKeySISQTPRWCVXBBJ-UHFFFAOYSA-N
MW325.63 g/mol
LogP5.61
Rot. Bonds2

About 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine

3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine (PubChem CID 82029766) has the molecular formula C15H11Cl3N2 and a molecular weight of 325.63 g/mol. Its IUPAC name is 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine
PubChem CID82029766
Molecular FormulaC15H11Cl3N2
Molecular Weight325.63 g/mol
Exact Mass324.00
IUPAC Name3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine
SMILESCC(Cl)c1c(-c2ccc(Cl)cc2Cl)nc2ccccn12
InChIInChI=1S/C15H11Cl3N2/c1-9(16)15-14(11-6-5-10(17)8-12(11)18)19-13-4-2-3-7-20(13)15/h2-9H,1H3
InChIKeySISQTPRWCVXBBJ-UHFFFAOYSA-N
XLogP5.61
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.63
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(1-chloroethyl)-2-(2,4-dichlorophenyl)-6-methylimidazo[1,2-a]pyridine
CID 82029820
2-(2,4-dichlorophenyl)-3-methylimidazo[1,2-a]pyridine;ethane
CID 155716211
[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol
CID 68625206
2-[[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]iminomethyl]phenol
CID 1237435
6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one
CID 10095226
2,4-dibromo-6-[[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]iminomethyl]phenol
CID 2244514
2-(2,5-dichlorophenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 71281270
6-chloro-3-(chloromethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine
CID 82029741
2-(1-chloroethyl)-3-methylimidazo[1,2-a]pyridine
CID 66646648
3-(chloromethyl)-2-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridine
CID 39133026
3-chloro-2-(2-phenylphenyl)imidazo[1,2-a]pyridine
CID 133055370
5-chloro-2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol
CID 143959387

Frequently Asked Questions

What is the IUPAC name of 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine (CID 82029766) is 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine is CC(Cl)c1c(-c2ccc(Cl)cc2Cl)nc2ccccn12.
What is the InChIKey of 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine?
The InChIKey is SISQTPRWCVXBBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl3N2/c1-9(16)15-14(11-6-5-10(17)8-12(11)18)19-13-4-2-3-7-20(13)15/h2-9H,1H3.
What are the key properties of 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine?
3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine has a molecular weight of 325.63 g/mol, XLogP of 5.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 82029766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).