N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide

C19H18FN3O2 — CID 126710537

IUPACN-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccn2c(C(=O)NCc3ccc4c(c3)C(F)CO4)c(C)nc2c1
InChIInChI=1S/C19H18FN3O2/c1-11-5-6-23-17(7-11)22-12(2)18(23)19(24)21-9-13-3-4-16-14(8-13)15(20)10-25-16/h3-8,15H,9-10H2,1-2H3,(H,21,24)
InChIKeyUOONENIIOLNVGT-UHFFFAOYSA-N
MW339.37 g/mol
LogP3.28
Rot. Bonds3

About N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide

N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 126710537) has the molecular formula C19H18FN3O2 and a molecular weight of 339.37 g/mol. Its IUPAC name is N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID126710537
Molecular FormulaC19H18FN3O2
Molecular Weight339.37 g/mol
Exact Mass339.14
IUPAC NameN-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccn2c(C(=O)NCc3ccc4c(c3)C(F)CO4)c(C)nc2c1
InChIInChI=1S/C19H18FN3O2/c1-11-5-6-23-17(7-11)22-12(2)18(23)19(24)21-9-13-3-4-16-14(8-13)15(20)10-25-16/h3-8,15H,9-10H2,1-2H3,(H,21,24)
InChIKeyUOONENIIOLNVGT-UHFFFAOYSA-N
XLogP3.28
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-chlorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 53248894
2,7-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 121274552
7-ethyl-2-methyl-N-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 171356527
5-[3-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-oxopropyl]-3H-1-benzofuran-2-one
CID 159453221
2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 137001767
N-[[3-fluoro-4-[4-(2,2,2-trifluoroethoxy)phenyl]phenyl]methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 163202255
N-(1,3-benzodioxol-5-ylmethyl)-2,8-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 70689272
N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide
CID 2814534
6,8-dideuterio-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-7-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 161394886
5,6,8-trideuterio-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 158827780
2,6-dimethyl-N-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 121274322
2,7-dimethyl-N-(2-phenoxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 134140165

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide (CID 126710537) is N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide is Cc1ccn2c(C(=O)NCc3ccc4c(c3)C(F)CO4)c(C)nc2c1.
What is the InChIKey of N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is UOONENIIOLNVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O2/c1-11-5-6-23-17(7-11)22-12(2)18(23)19(24)21-9-13-3-4-16-14(8-13)15(20)10-25-16/h3-8,15H,9-10H2,1-2H3,(H,21,24).
What are the key properties of N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 339.37 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 126710537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).