N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine

C21H17ClFN3 — CID 59579102

IUPACN-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc(Cl)c1Nc1c(-c2ccccc2F)nc2cccc(C)n12
InChIInChI=1S/C21H17ClFN3/c1-13-7-5-10-16(22)19(13)25-21-20(15-9-3-4-11-17(15)23)24-18-12-6-8-14(2)26(18)21/h3-12,25H,1-2H3
InChIKeyIQLOZFIBLAOTME-UHFFFAOYSA-N
MW365.84 g/mol
LogP6.15
Rot. Bonds3

About N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine

N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 59579102) has the molecular formula C21H17ClFN3 and a molecular weight of 365.84 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID59579102
Molecular FormulaC21H17ClFN3
Molecular Weight365.84 g/mol
Exact Mass365.11
IUPAC NameN-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc(Cl)c1Nc1c(-c2ccccc2F)nc2cccc(C)n12
InChIInChI=1S/C21H17ClFN3/c1-13-7-5-10-16(22)19(13)25-21-20(15-9-3-4-11-17(15)23)24-18-12-6-8-14(2)26(18)21/h3-12,25H,1-2H3
InChIKeyIQLOZFIBLAOTME-UHFFFAOYSA-N
XLogP6.15
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.84
LogP ≤ 56.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine (CID 59579102) is N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine is Cc1cccc(Cl)c1Nc1c(-c2ccccc2F)nc2cccc(C)n12.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is IQLOZFIBLAOTME-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClFN3/c1-13-7-5-10-16(22)19(13)25-21-20(15-9-3-4-11-17(15)23)24-18-12-6-8-14(2)26(18)21/h3-12,25H,1-2H3.
What are the key properties of N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 365.84 g/mol, XLogP of 6.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 59579102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).