3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine

C15H12Cl2N2 — CID 39133020

IUPAC3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine
SMILESCc1ccn2c(CCl)c(-c3ccc(Cl)cc3)nc2c1
InChIInChI=1S/C15H12Cl2N2/c1-10-6-7-19-13(9-16)15(18-14(19)8-10)11-2-4-12(17)5-3-11/h2-8H,9H2,1H3
InChIKeyNAHONBFMGVSLCT-UHFFFAOYSA-N
MW291.18 g/mol
LogP4.70
Rot. Bonds2

About 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine

3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine (PubChem CID 39133020) has the molecular formula C15H12Cl2N2 and a molecular weight of 291.18 g/mol. Its IUPAC name is 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine
PubChem CID39133020
Molecular FormulaC15H12Cl2N2
Molecular Weight291.18 g/mol
Exact Mass290.04
IUPAC Name3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine
SMILESCc1ccn2c(CCl)c(-c3ccc(Cl)cc3)nc2c1
InChIInChI=1S/C15H12Cl2N2/c1-10-6-7-19-13(9-16)15(18-14(19)8-10)11-2-4-12(17)5-3-11/h2-8H,9H2,1H3
InChIKeyNAHONBFMGVSLCT-UHFFFAOYSA-N
XLogP4.70
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.18
LogP ≤ 54.70
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

1-[2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine;hydrochloride
CID 126467593
3-(chloromethyl)-2-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridine
CID 39133026
2-(4-bromophenyl)-3-ethyl-7-methylimidazo[1,2-a]pyridine
CID 100820877
3-chloro-2-(4-iodophenyl)-7-methylimidazo[1,2-a]pyridine
CID 148822779
3-(chloromethyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 39126150
6-chloro-3-(chloromethyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridine;hydrochloride
CID 67028658
2-[2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide;hydrochloride
CID 56591516
1-[2-(4-ethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine;dihydrochloride
CID 75537301
3-(chloromethyl)-2-(2-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridine
CID 39133040
methyl 2-[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanimidate
CID 70030368
[2-[(4-chlorophenyl)methyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methanol
CID 82223695
[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199352

Frequently Asked Questions

What is the IUPAC name of 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine?
The IUPAC name of 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine (CID 39133020) is 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine is Cc1ccn2c(CCl)c(-c3ccc(Cl)cc3)nc2c1.
What is the InChIKey of 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine?
The InChIKey is NAHONBFMGVSLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2/c1-10-6-7-19-13(9-16)15(18-14(19)8-10)11-2-4-12(17)5-3-11/h2-8H,9H2,1H3.
What are the key properties of 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine?
3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine has a molecular weight of 291.18 g/mol, XLogP of 4.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 39133020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).