3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide

C20H14F3N5O — CID 69004552

IUPAC3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NCc1ccc(C(F)(F)F)cn1)c1nc(-c2cccnc2)n2ccccc12
InChIInChI=1S/C20H14F3N5O/c21-20(22,23)14-6-7-15(25-11-14)12-26-19(29)17-16-5-1-2-9-28(16)18(27-17)13-4-3-8-24-10-13/h1-11H,12H2,(H,26,29)
InChIKeyBWQVXYNVJVIILW-UHFFFAOYSA-N
MW397.36 g/mol
LogP3.74
Rot. Bonds4

About 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide

3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 69004552) has the molecular formula C20H14F3N5O and a molecular weight of 397.36 g/mol. Its IUPAC name is 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID69004552
Molecular FormulaC20H14F3N5O
Molecular Weight397.36 g/mol
Exact Mass397.12
IUPAC Name3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NCc1ccc(C(F)(F)F)cn1)c1nc(-c2cccnc2)n2ccccc12
InChIInChI=1S/C20H14F3N5O/c21-20(22,23)14-6-7-15(25-11-14)12-26-19(29)17-16-5-1-2-9-28(16)18(27-17)13-4-3-8-24-10-13/h1-11H,12H2,(H,26,29)
InChIKeyBWQVXYNVJVIILW-UHFFFAOYSA-N
XLogP3.74
TPSA72.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.36
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-pyridin-3-yl-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 69004411
N-(1-phenylcyclopropyl)-3-pyridin-3-ylimidazo[1,5-a]pyridine-1-carboxamide
CID 70944014
3-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 70943829
3-N-benzyl-1-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070267
N-(isoquinolin-1-ylmethyl)-3-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 25160141
N-[(2,5-dimethoxyphenyl)methyl]-3-[1-(pyridin-3-ylmethyl)pyrrol-3-yl]imidazo[1,5-a]pyridine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 155849060
3-pyridin-3-ylimidazo[1,5-a]pyridine-1,7-dicarboxylic acid
CID 117251777
1-N-[(2-methylphenyl)methyl]-3-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070302
3-[4-(trifluoromethyl)phenyl]-1-[[3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]diselanyl]imidazo[1,5-a]pyridine
CID 139262365
3-(1-phenylimidazol-4-yl)-N-(2-pyridin-3-ylethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 97447063
1-N-(2-fluorophenyl)-3-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070701
3-(4-fluorophenyl)-N-[(1S)-2,2,2-trifluoro-1-pyridin-2-ylethyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 58023866

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide (CID 69004552) is 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide is O=C(NCc1ccc(C(F)(F)F)cn1)c1nc(-c2cccnc2)n2ccccc12.
What is the InChIKey of 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is BWQVXYNVJVIILW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F3N5O/c21-20(22,23)14-6-7-15(25-11-14)12-26-19(29)17-16-5-1-2-9-28(16)18(27-17)13-4-3-8-24-10-13/h1-11H,12H2,(H,26,29).
What are the key properties of 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide?
3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 397.36 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-yl-N-[[5-(trifluoromethyl)-2-pyridinyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 69004552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).