2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide

C20H26F2N6O — CID 164558263

IUPAC2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide
SMILESCC1CCC(Nc2cccc3nc(C(F)F)cn23)CC1.Cn1nccc1C(N)=O
InChIInChI=1S/C15H19F2N3.C5H7N3O/c1-10-5-7-11(8-6-10)18-13-3-2-4-14-19-12(15(16)17)9-20(13)14;1-8-4(5(6)9)2-3-7-8/h2-4,9-11,15,18H,5-8H2,1H3;2-3H,1H3,(H2,6,9)
InChIKeyUYAZQFLTSLLFFI-UHFFFAOYSA-N
MW404.47 g/mol
LogP3.78
Rot. Bonds4

About 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide

2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide (PubChem CID 164558263) has the molecular formula C20H26F2N6O and a molecular weight of 404.47 g/mol. Its IUPAC name is 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide
PubChem CID164558263
Molecular FormulaC20H26F2N6O
Molecular Weight404.47 g/mol
Exact Mass404.21
IUPAC Name2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide
SMILESCC1CCC(Nc2cccc3nc(C(F)F)cn23)CC1.Cn1nccc1C(N)=O
InChIInChI=1S/C15H19F2N3.C5H7N3O/c1-10-5-7-11(8-6-10)18-13-3-2-4-14-19-12(15(16)17)9-20(13)14;1-8-4(5(6)9)2-3-7-8/h2-4,9-11,15,18H,5-8H2,1H3;2-3H,1H3,(H2,6,9)
InChIKeyUYAZQFLTSLLFFI-UHFFFAOYSA-N
XLogP3.78
TPSA90.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-(1H-imidazol-1-yl)propyl)-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3113005
1-(3-carbamimidoylphenyl)-N-[4-(1H-imidazol-1-yl)phenyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
CID 18549509
N~4~,N~4~,1-trimethyl-N~5~-[(4R)-2-phenylimidazo[1,2-a]pyridin-7-yl]-1H-pyrazole-4,5-dicarboxamide
CID 51033482
1-methyl-4-(morpholine-4-carbonyl)-N-[(4R)-2-phenylimidazo[1,2-a]pyridin-7-yl]-1H-pyrazole-5-carboxamide
CID 51034710
4-(3-fluoroazetidine-1-carbonyl)-1-methyl-N-(2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide
CID 57377630
4-(azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid (6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-amide
CID 57377741
2-[6-(diethylamino)pyridin-3-yl]-1-[(1-ethyl-1H-pyrazol-3-yl)methyl]-N-methyl-1H-1,3-benzodiazole-5-carboxamide
CID 138466007
1-(3-carbamimidoylphenyl)-N-(2-fluoro-4-{1H-imidazo[4,5-b]pyridin-1-yl}phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
CID 23646189
1-(3-carbamimidoylphenyl)-N-(2-fluoro-4-{1H-imidazo[4,5-c]pyridin-1-yl}phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
CID 23646190
1-(3-carbamimidoylphenyl)-N-(2-fluoro-4-{3H-imidazo[4,5-c]pyridin-3-yl}phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
CID 23646191
1-(3-carbamimidoylphenyl)-N-(2-fluoro-4-{3H-imidazo[4,5-b]pyridin-3-yl}phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
CID 23646192
2-methyl-3-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-4-N-[[6-(trifluoromethyl)pyridin-3-yl]methyl]pyrazole-3,4-dicarboxamide
CID 53469250

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide?
The IUPAC name of 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide (CID 164558263) is 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide.
What is the SMILES notation for 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide?
The canonical SMILES for 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide is CC1CCC(Nc2cccc3nc(C(F)F)cn23)CC1.Cn1nccc1C(N)=O.
What is the InChIKey of 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide?
The InChIKey is UYAZQFLTSLLFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F2N3.C5H7N3O/c1-10-5-7-11(8-6-10)18-13-3-2-4-14-19-12(15(16)17)9-20(13)14;1-8-4(5(6)9)2-3-7-8/h2-4,9-11,15,18H,5-8H2,1H3;2-3H,1H3,(H2,6,9).
What are the key properties of 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide?
2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide has a molecular weight of 404.47 g/mol, XLogP of 3.78, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-N-(4-methylcyclohexyl)imidazo[1,2-a]pyridin-5-amine;2-methylpyrazole-3-carboxamide is sourced from PubChem (CID 164558263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).