7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine

C60H62F6N10O7 — CID 157389156

IUPAC7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine
SMILESCCOC(=O)c1c(C)nc2ccc(C)cn12.NCc1ccc(C(F)(F)F)cc1.[2H]c1c(C)cn2c(C(=O)NCc3ccc(C(F)(F)F)cc3)c(C([2H])([2H])[2H])nc2c1[2H].[2H]c1c(C)cn2c(C(=O)O)c(C([2H])([2H])[2H])nc2c1[2H].[2H]c1c(C)cn2c(C(=O)OCC)c(C([2H])([2H])[2H])nc2c1[2H]
InChIInChI=1S/C18H16F3N3O.2C12H14N2O2.C10H10N2O2.C8H8F3N/c1-11-3-8-15-23-12(2)16(24(15)10-11)17(25)22-9-13-4-6-14(7-5-13)18(19,20)21;2*1-4-16-12(15)11-9(3)13-10-6-5-8(2)7-14(10)11;1-6-3-4-8-11-7(2)9(10(13)14)12(8)5-6;9-8(10,11)7-3-1-6(5-12)2-4-7/h3-8,10H,9H2,1-2H3,(H,22,25);2*5-7H,4H2,1-3H3;3-5H,1-2H3,(H,13,14);1-4H,5,12H2/i2D3,3D,8D;3D3,5D,6D;;2D3,3D,4D;
InChIKeyBLUFCLDZCPKRBA-NODWNJDMSA-N
MW1164.30 g/mol
LogP11.97
Rot. Bonds12

About 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine

7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine (PubChem CID 157389156) has the molecular formula C60H62F6N10O7 and a molecular weight of 1164.30 g/mol. Its IUPAC name is 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine
PubChem CID157389156
Molecular FormulaC60H62F6N10O7
Molecular Weight1164.30 g/mol
Exact Mass1163.56
IUPAC Name7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine
SMILESCCOC(=O)c1c(C)nc2ccc(C)cn12.NCc1ccc(C(F)(F)F)cc1.[2H]c1c(C)cn2c(C(=O)NCc3ccc(C(F)(F)F)cc3)c(C([2H])([2H])[2H])nc2c1[2H].[2H]c1c(C)cn2c(C(=O)O)c(C([2H])([2H])[2H])nc2c1[2H].[2H]c1c(C)cn2c(C(=O)OCC)c(C([2H])([2H])[2H])nc2c1[2H]
InChIInChI=1S/C18H16F3N3O.2C12H14N2O2.C10H10N2O2.C8H8F3N/c1-11-3-8-15-23-12(2)16(24(15)10-11)17(25)22-9-13-4-6-14(7-5-13)18(19,20)21;2*1-4-16-12(15)11-9(3)13-10-6-5-8(2)7-14(10)11;1-6-3-4-8-11-7(2)9(10(13)14)12(8)5-6;9-8(10,11)7-3-1-6(5-12)2-4-7/h3-8,10H,9H2,1-2H3,(H,22,25);2*5-7H,4H2,1-3H3;3-5H,1-2H3,(H,13,14);1-4H,5,12H2/i2D3,3D,8D;3D3,5D,6D;;2D3,3D,4D;
InChIKeyBLUFCLDZCPKRBA-NODWNJDMSA-N
XLogP11.97
TPSA214.22 Ų
H-Bond Donors3
H-Bond Acceptors15
Rotatable Bonds12
Heavy Atoms83
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001164.30
LogP ≤ 511.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1015

Analyze 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

PSJ-2510-up
CID 139095417
N-(2,2-difluoroethyl)-6-[2-(6-methylpyridin-2-yl)pyridin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-methylpyridin-2-yl)pyridin-3-yl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 122478588
1-amino-5,5,5-trifluoropentan-2-one;methyl 8-[5-[3,5-bis(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]imidazo[1,2-a]pyridine-5-carboxylate;8-[5-[3-methyl-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]imidazo[1,2-a]pyridine-5-carboxylic acid;8-[5-[3-methyl-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]-N-(5,5,5-trifluoro-2-oxopentyl)imidazo[1,2-a]pyridine-5-carboxamide
CID 123960519
[3-ethyl-8-[1-[[3-[3-[3-ethyl-6-oxo-7-(pyridine-4-carbonyloxymethyl)-8-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-2H-purin-1-yl]propyl]-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-2,6-dioxo-1-propylpurin-7-yl]methyl pyrimidine-2-carboxylate
CID 139477618
ethyl 2-chloro-3-oxobutanoate;ethyl 5,7,8-trideuterio-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;5-methylpyridin-2-amine;5,7,8-trideuterio-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid;5,7,8-trideuterio-2,6-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;3,4,6-trideuterio-5-methylpyridin-2-amine;[4-(trifluoromethyl)phenyl]methanamine
CID 157092700
3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[(2S)-4,4-difluoro-1-methylpyrrolidin-2-yl]propan-1-one;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[(2S)-4,4-difluoropyrrolidin-2-yl]propan-1-one;tert-butyl (2R)-2-(aminomethyl)-4,4-difluoropyrrolidine-1-carboxylate;tert-butyl (2S)-2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-4,4-difluoropyrrolidine-1-carboxylate
CID 157321542
3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[(2R)-4,4-difluoro-1-methylpyrrolidin-2-yl]propan-1-one;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[(2R)-4,4-difluoropyrrolidin-2-yl]propan-1-one;tert-butyl (2S)-2-(aminomethyl)-4,4-difluoropyrrolidine-1-carboxylate;tert-butyl (2R)-2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-4,4-difluoropyrrolidine-1-carboxylate
CID 157321546
ethyl 2-bromoacetate;ethyl 2-(3-methyl-2,6-dioxopurin-7-yl)acetate;2-(3-methyl-2,6-dioxopurin-7-yl)acetic acid;2-(3-methyl-2,6-dioxopurin-7-yl)-N-[6-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-methyl-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;6-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]pyridin-2-amine
CID 157380999
Ethyl 7-ethyl-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;2,2,2-trifluoroethyl 7-ethyl-2-phenylimidazo[1,2-a]pyridine-3-carboxylate
CID 157510002
Ethyl 2-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyrimidine-8-carboxylate;2-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyrimidine-8-carboxylic acid
CID 157676744
tert-butyl 4-[[1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carbonyl]amino]piperidine-1-carboxylate;ethyl 1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carboxylate;1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-N-piperidin-4-yl-2-[3-(trifluoromethyl)phenyl]imidazole-4-carboxamide;1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carboxylic acid
CID 157726574
1,3-dimethyl-5-[3-(N-methylanilino)imidazo[1,2-a]pyridin-6-yl]pyridin-2-one;1,3-dimethyl-5-[3-(pyridin-2-ylmethyl)imidazo[1,2-a]pyridin-6-yl]pyridin-2-one;1,3-dimethyl-5-[3-(2,2,2-trifluoroethoxymethyl)imidazo[1,2-a]pyridin-6-yl]pyridin-2-one;5-[3-(ethoxymethyl)imidazo[1,2-a]pyridin-6-yl]-1,3-dimethylpyridin-2-one
CID 157739853

Frequently Asked Questions

What is the IUPAC name of 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine?
The IUPAC name of 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine (CID 157389156) is 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine.
What is the SMILES notation for 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine?
The canonical SMILES for 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine is CCOC(=O)c1c(C)nc2ccc(C)cn12.NCc1ccc(C(F)(F)F)cc1.[2H]c1c(C)cn2c(C(=O)NCc3ccc(C(F)(F)F)cc3)c(C([2H])([2H])[2H])nc2c1[2H].[2H]c1c(C)cn2c(C(=O)O)c(C([2H])([2H])[2H])nc2c1[2H].[2H]c1c(C)cn2c(C(=O)OCC)c(C([2H])([2H])[2H])nc2c1[2H].
What is the InChIKey of 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine?
The InChIKey is BLUFCLDZCPKRBA-NODWNJDMSA-N. The full InChI is InChI=1S/C18H16F3N3O.2C12H14N2O2.C10H10N2O2.C8H8F3N/c1-11-3-8-15-23-12(2)16(24(15)10-11)17(25)22-9-13-4-6-14(7-5-13)18(19,20)21;2*1-4-16-12(15)11-9(3)13-10-6-5-8(2)7-14(10)11;1-6-3-4-8-11-7(2)9(10(13)14)12(8)5-6;9-8(10,11)7-3-1-6(5-12)2-4-7/h3-8,10H,9H2,1-2H3,(H,22,25);2*5-7H,4H2,1-3H3;3-5H,1-2H3,(H,13,14);1-4H,5,12H2/i2D3,3D,8D;3D3,5D,6D;;2D3,3D,4D;.
What are the key properties of 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine?
7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine has a molecular weight of 1164.30 g/mol, XLogP of 11.97, 12 rotatable bonds, 3 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylic acid;7,8-dideuterio-6-methyl-2-(trideuteriomethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;ethyl 7,8-dideuterio-6-methyl-2-(trideuteriomethyl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylate;[4-(trifluoromethyl)phenyl]methanamine is sourced from PubChem (CID 157389156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).