3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine

C15H14ClN3 — CID 82029837

IUPAC3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine
SMILESCc1ccc2nc(-c3cccnc3)c(C(C)Cl)n2c1
InChIInChI=1S/C15H14ClN3/c1-10-5-6-13-18-14(12-4-3-7-17-8-12)15(11(2)16)19(13)9-10/h3-9,11H,1-2H3
InChIKeyKZMFYGHRRNFYGK-UHFFFAOYSA-N
MW271.75 g/mol
LogP4.00
Rot. Bonds2

About 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine

3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine (PubChem CID 82029837) has the molecular formula C15H14ClN3 and a molecular weight of 271.75 g/mol. Its IUPAC name is 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine
PubChem CID82029837
Molecular FormulaC15H14ClN3
Molecular Weight271.75 g/mol
Exact Mass271.09
IUPAC Name3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine
SMILESCc1ccc2nc(-c3cccnc3)c(C(C)Cl)n2c1
InChIInChI=1S/C15H14ClN3/c1-10-5-6-13-18-14(12-4-3-7-17-8-12)15(11(2)16)19(13)9-10/h3-9,11H,1-2H3
InChIKeyKZMFYGHRRNFYGK-UHFFFAOYSA-N
XLogP4.00
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.75
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)propanethioamide
CID 82030210
N,N-dimethyl-1-(6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 82530360
3-(1-chloroethyl)-2-(4-ethylphenyl)-6-methylimidazo[1,2-a]pyridine
CID 82029815
N-(4-chlorophenyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-amine
CID 7012493
1-(6-chloro-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)propan-1-ol
CID 82029578
1-[6-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanol
CID 82029395
2-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanenitrile
CID 82029976
1-(7-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)ethanol
CID 82029433
6-methyl-2-(4-methylphenyl)-3-(pyridin-3-yloxymethyl)imidazo[1,2-a]pyridine
CID 67027547
N-(1,3-benzodioxol-5-yl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-amine
CID 15995780
6-chloro-N-(3-methylbutyl)-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-amine
CID 861017
6-chloro-N-(2-methylphenyl)-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-amine
CID 15989623

Frequently Asked Questions

What is the IUPAC name of 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine?
The IUPAC name of 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine (CID 82029837) is 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine is Cc1ccc2nc(-c3cccnc3)c(C(C)Cl)n2c1.
What is the InChIKey of 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine?
The InChIKey is KZMFYGHRRNFYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3/c1-10-5-6-13-18-14(12-4-3-7-17-8-12)15(11(2)16)19(13)9-10/h3-9,11H,1-2H3.
What are the key properties of 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine?
3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine has a molecular weight of 271.75 g/mol, XLogP of 4.00, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-chloroethyl)-6-methyl-2-pyridin-3-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 82029837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).