2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine

C24H19FN4O — CID 67004847

IUPAC2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine
SMILESCc1ncc(-c2ccc(Nc3cccn4cc(Cc5ccc(F)cc5)nc34)cc2)o1
InChIInChI=1S/C24H19FN4O/c1-16-26-14-23(30-16)18-6-10-20(11-7-18)27-22-3-2-12-29-15-21(28-24(22)29)13-17-4-8-19(25)9-5-17/h2-12,14-15,27H,13H2,1H3
InChIKeySWRHENXYSSHHCM-UHFFFAOYSA-N
MW398.44 g/mol
LogP5.77
Rot. Bonds5

About 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine

2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine (PubChem CID 67004847) has the molecular formula C24H19FN4O and a molecular weight of 398.44 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine
PubChem CID67004847
Molecular FormulaC24H19FN4O
Molecular Weight398.44 g/mol
Exact Mass398.15
IUPAC Name2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine
SMILESCc1ncc(-c2ccc(Nc3cccn4cc(Cc5ccc(F)cc5)nc34)cc2)o1
InChIInChI=1S/C24H19FN4O/c1-16-26-14-23(30-16)18-6-10-20(11-7-18)27-22-3-2-12-29-15-21(28-24(22)29)13-17-4-8-19(25)9-5-17/h2-12,14-15,27H,13H2,1H3
InChIKeySWRHENXYSSHHCM-UHFFFAOYSA-N
XLogP5.77
TPSA55.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.44
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine?
The IUPAC name of 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine (CID 67004847) is 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine.
What is the SMILES notation for 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine?
The canonical SMILES for 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine is Cc1ncc(-c2ccc(Nc3cccn4cc(Cc5ccc(F)cc5)nc34)cc2)o1.
What is the InChIKey of 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine?
The InChIKey is SWRHENXYSSHHCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN4O/c1-16-26-14-23(30-16)18-6-10-20(11-7-18)27-22-3-2-12-29-15-21(28-24(22)29)13-17-4-8-19(25)9-5-17/h2-12,14-15,27H,13H2,1H3.
What are the key properties of 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine?
2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine has a molecular weight of 398.44 g/mol, XLogP of 5.77, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methyl]-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine is sourced from PubChem (CID 67004847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).