6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide

C22H19FN4O — CID 158663541

IUPAC6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILES[2H]C([2H])([2H])N(C(=O)c1cnc2ccc(-c3cc(F)ccc3-c3cccc(C)n3)cn12)C([2H])([2H])[2H]
InChIInChI=1S/C22H19FN4O/c1-14-5-4-6-19(25-14)17-9-8-16(23)11-18(17)15-7-10-21-24-12-20(27(21)13-15)22(28)26(2)3/h4-13H,1-3H3/i2D3,3D3
InChIKeyQBKFGFYLGFERDV-XERRXZQWSA-N
MW380.46 g/mol
LogP4.21
Rot. Bonds5

About 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide

6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 158663541) has the molecular formula C22H19FN4O and a molecular weight of 380.46 g/mol. Its IUPAC name is 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID158663541
Molecular FormulaC22H19FN4O
Molecular Weight380.46 g/mol
Exact Mass380.19
IUPAC Name6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILES[2H]C([2H])([2H])N(C(=O)c1cnc2ccc(-c3cc(F)ccc3-c3cccc(C)n3)cn12)C([2H])([2H])[2H]
InChIInChI=1S/C22H19FN4O/c1-14-5-4-6-19(25-14)17-9-8-16(23)11-18(17)15-7-10-21-24-12-20(27(21)13-15)22(28)26(2)3/h4-13H,1-3H3/i2D3,3D3
InChIKeyQBKFGFYLGFERDV-XERRXZQWSA-N
XLogP4.21
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.46
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 138706947
6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 158663540
6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-[5-[(2-fluorophenyl)methoxy]-2-(6-methyl-2-pyridinyl)phenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-methyl-2-pyridinyl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide;7-[2-(6-methyl-2-pyridinyl)phenyl]quinoxaline-2-carboxamide;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-[4-(6-methyl-2-pyridinyl)thiophen-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 161106027
6-[4-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 138707025
N-hydroxy-6-[2-(6-methyl-2-pyridinyl)phenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-methyl-2-pyridinyl)phenyl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 160787721
6-tert-butyl-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 159807807
6-[5-fluoro-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carbonitrile
CID 122478654
6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 122478437
N-[5-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-6-(6-methyl-2-pyridinyl)-3-pyridinyl]acetamide
CID 122478505
N,N-dimethyl-3-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyrazine-6-carboxamide
CID 153330943
2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol
CID 134202478
6-[3-(4-fluorophenyl)-5-methyl-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 139527802

Frequently Asked Questions

What is the IUPAC name of 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide (CID 158663541) is 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide is [2H]C([2H])([2H])N(C(=O)c1cnc2ccc(-c3cc(F)ccc3-c3cccc(C)n3)cn12)C([2H])([2H])[2H].
What is the InChIKey of 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is QBKFGFYLGFERDV-XERRXZQWSA-N. The full InChI is InChI=1S/C22H19FN4O/c1-14-5-4-6-19(25-14)17-9-8-16(23)11-18(17)15-7-10-21-24-12-20(27(21)13-15)22(28)26(2)3/h4-13H,1-3H3/i2D3,3D3.
What are the key properties of 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide?
6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 380.46 g/mol, XLogP of 4.21, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-fluoro-2-(6-methyl-2-pyridinyl)phenyl]-N,N-bis(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 158663541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).