7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine

C15H13ClN2 — CID 82064406

IUPAC7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine
SMILESCc1c(-c2ccccc2)nc2cc(CCl)ccn12
InChIInChI=1S/C15H13ClN2/c1-11-15(13-5-3-2-4-6-13)17-14-9-12(10-16)7-8-18(11)14/h2-9H,10H2,1H3
InChIKeyABGWIVINSPYYQG-UHFFFAOYSA-N
MW256.74 g/mol
LogP4.05
Rot. Bonds2

About 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine

7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine (PubChem CID 82064406) has the molecular formula C15H13ClN2 and a molecular weight of 256.74 g/mol. Its IUPAC name is 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine
PubChem CID82064406
Molecular FormulaC15H13ClN2
Molecular Weight256.74 g/mol
Exact Mass256.08
IUPAC Name7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine
SMILESCc1c(-c2ccccc2)nc2cc(CCl)ccn12
InChIInChI=1S/C15H13ClN2/c1-11-15(13-5-3-2-4-6-13)17-14-9-12(10-16)7-8-18(11)14/h2-9H,10H2,1H3
InChIKeyABGWIVINSPYYQG-UHFFFAOYSA-N
XLogP4.05
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 54.05
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

7-(chloromethyl)-2-(4-chloro-3-methylphenyl)-3-methylimidazo[1,2-a]pyridine
CID 93213204
[3-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 82059865
[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 82059872
7-(chloromethyl)-3-ethyl-2-thiophen-2-ylimidazo[1,2-a]pyridine
CID 82064405
3-methyl-2-phenylimidazo[2,1-a]isoquinoline
CID 757851
[4-(3-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol
CID 70813399
7-bromo-3-(chloromethyl)-2-phenylimidazo[1,2-a]pyridine;(7-bromo-2-phenylimidazo[1,2-a]pyridin-3-yl)methanol
CID 157427300
ethane;8-methyl-2-(3-methyl-2-phenylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine
CID 144500093
3-(dideuteriomethyl)-2-phenylimidazo[1,2-a]pyridine
CID 66561866
[2-(2,4-dimethylphenyl)-3-methylimidazo[1,2-a]pyridin-7-yl]methanol
CID 82064373
[2-phenyl-7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol
CID 82530079
3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine
CID 39133020

Frequently Asked Questions

What is the IUPAC name of 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine?
The IUPAC name of 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine (CID 82064406) is 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine.
What is the SMILES notation for 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine?
The canonical SMILES for 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine is Cc1c(-c2ccccc2)nc2cc(CCl)ccn12.
What is the InChIKey of 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine?
The InChIKey is ABGWIVINSPYYQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2/c1-11-15(13-5-3-2-4-6-13)17-14-9-12(10-16)7-8-18(11)14/h2-9H,10H2,1H3.
What are the key properties of 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine?
7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine has a molecular weight of 256.74 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(chloromethyl)-3-methyl-2-phenylimidazo[1,2-a]pyridine is sourced from PubChem (CID 82064406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).