N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide

C17H16FN3O — CID 53248895

IUPACN-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccn2c(C(=O)NCc3cccc(F)c3)c(C)nc2c1
InChIInChI=1S/C17H16FN3O/c1-11-6-7-21-15(8-11)20-12(2)16(21)17(22)19-10-13-4-3-5-14(18)9-13/h3-9H,10H2,1-2H3,(H,19,22)
InChIKeyBWXUGJGNGYRXEB-UHFFFAOYSA-N
MW297.33 g/mol
LogP3.02
Rot. Bonds3

About N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide

N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 53248895) has the molecular formula C17H16FN3O and a molecular weight of 297.33 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID53248895
Molecular FormulaC17H16FN3O
Molecular Weight297.33 g/mol
Exact Mass297.13
IUPAC NameN-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccn2c(C(=O)NCc3cccc(F)c3)c(C)nc2c1
InChIInChI=1S/C17H16FN3O/c1-11-6-7-21-15(8-11)20-12(2)16(21)17(22)19-10-13-4-3-5-14(18)9-13/h3-9H,10H2,1-2H3,(H,19,22)
InChIKeyBWXUGJGNGYRXEB-UHFFFAOYSA-N
XLogP3.02
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide (CID 53248895) is N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide is Cc1ccn2c(C(=O)NCc3cccc(F)c3)c(C)nc2c1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is BWXUGJGNGYRXEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O/c1-11-6-7-21-15(8-11)20-12(2)16(21)17(22)19-10-13-4-3-5-14(18)9-13/h3-9H,10H2,1-2H3,(H,19,22).
What are the key properties of N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 297.33 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 53248895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).