[6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine

C21H17ClFN3 — CID 143550682

IUPAC[6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
SMILESCc1ccc(-c2cn3c(-c4ccc(F)cc4)cnc3cc2CN)c(Cl)c1
InChIInChI=1S/C21H17ClFN3/c1-13-2-7-17(19(22)8-13)18-12-26-20(14-3-5-16(23)6-4-14)11-25-21(26)9-15(18)10-24/h2-9,11-12H,10,24H2,1H3
InChIKeyNSCRAIHBIQKENQ-UHFFFAOYSA-N
MW365.84 g/mol
LogP5.23
Rot. Bonds3

About [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine

[6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine (PubChem CID 143550682) has the molecular formula C21H17ClFN3 and a molecular weight of 365.84 g/mol. Its IUPAC name is [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine.

Molecular Properties

Compound Name[6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
PubChem CID143550682
Molecular FormulaC21H17ClFN3
Molecular Weight365.84 g/mol
Exact Mass365.11
IUPAC Name[6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
SMILESCc1ccc(-c2cn3c(-c4ccc(F)cc4)cnc3cc2CN)c(Cl)c1
InChIInChI=1S/C21H17ClFN3/c1-13-2-7-17(19(22)8-13)18-12-26-20(14-3-5-16(23)6-4-14)11-25-21(26)9-15(18)10-24/h2-9,11-12H,10,24H2,1H3
InChIKeyNSCRAIHBIQKENQ-UHFFFAOYSA-N
XLogP5.23
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.84
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-(aminomethyl)-6-(2-chloro-4-fluorophenyl)-N-methyl-N-propylimidazo[1,2-a]pyridin-3-amine
CID 143550630
7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-amine
CID 24849785
1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 66659374
1-[4-[7-(aminomethyl)-6-(2-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]pentan-1-one
CID 143550753
1-[4-[7-(aminomethyl)-6-(2-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]pentan-1-one;ethane
CID 143550752
[6-(2-chloro-4-methylphenyl)-3-morpholin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl]methanamine
CID 143550755
[7-(aminomethyl)-6-(2-chloro-4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;ethyl formate
CID 143550647
1-[7-(aminomethyl)-6-(2,4-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-N,N-dimethylpiperidin-4-amine
CID 70312257
6-bromo-3-(4-fluorophenyl)imidazo[1,2-a]pyrazine
CID 89429108
[4-(2-chloro-4-fluorophenyl)-1-[(4-methylphenyl)methyl]imidazol-2-yl]methanamine
CID 91450317
[6-[(2-chloro-4-fluorophenyl)methyl]-3-piperidin-1-ylimidazo[1,2-a]pyridin-7-yl]methanamine
CID 143550666
[2,6-bis(2-chloro-4-methylphenyl)phenyl]methanamine
CID 166447795

Frequently Asked Questions

What is the IUPAC name of [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The IUPAC name of [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine (CID 143550682) is [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine.
What is the SMILES notation for [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The canonical SMILES for [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine is Cc1ccc(-c2cn3c(-c4ccc(F)cc4)cnc3cc2CN)c(Cl)c1.
What is the InChIKey of [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The InChIKey is NSCRAIHBIQKENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClFN3/c1-13-2-7-17(19(22)8-13)18-12-26-20(14-3-5-16(23)6-4-14)11-25-21(26)9-15(18)10-24/h2-9,11-12H,10,24H2,1H3.
What are the key properties of [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
[6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine has a molecular weight of 365.84 g/mol, XLogP of 5.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-chloro-4-methylphenyl)-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanamine is sourced from PubChem (CID 143550682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).