N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine

C19H14F2N4O — CID 162661873

IUPACN-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccn2c(Nc3cc(F)cc(F)c3)c(-c3ccccn3)nc2c1
InChIInChI=1S/C19H14F2N4O/c1-26-15-5-7-25-17(11-15)24-18(16-4-2-3-6-22-16)19(25)23-14-9-12(20)8-13(21)10-14/h2-11,23H,1H3
InChIKeyJHIKJNLLFMMIJA-UHFFFAOYSA-N
MW352.34 g/mol
LogP4.43
Rot. Bonds4

About N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine

N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine (PubChem CID 162661873) has the molecular formula C19H14F2N4O and a molecular weight of 352.34 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
PubChem CID162661873
Molecular FormulaC19H14F2N4O
Molecular Weight352.34 g/mol
Exact Mass352.11
IUPAC NameN-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccn2c(Nc3cc(F)cc(F)c3)c(-c3ccccn3)nc2c1
InChIInChI=1S/C19H14F2N4O/c1-26-15-5-7-25-17(11-15)24-18(16-4-2-3-6-22-16)19(25)23-14-9-12(20)8-13(21)10-14/h2-11,23H,1H3
InChIKeyJHIKJNLLFMMIJA-UHFFFAOYSA-N
XLogP4.43
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.34
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_65_Db(5)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine (CID 162661873) is N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine is COc1ccn2c(Nc3cc(F)cc(F)c3)c(-c3ccccn3)nc2c1.
What is the InChIKey of N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is JHIKJNLLFMMIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N4O/c1-26-15-5-7-25-17(11-15)24-18(16-4-2-3-6-22-16)19(25)23-14-9-12(20)8-13(21)10-14/h2-11,23H,1H3.
What are the key properties of N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 352.34 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-7-methoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 162661873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).