6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

C20H17F3N4O2 — CID 154655655

IUPAC6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCOc1cc(NC(=O)c2cccc(C(F)F)n2)cn2cc(C34CC(F)(C3)C4)nc12
InChIInChI=1S/C20H17F3N4O2/c1-29-14-5-11(24-18(28)13-4-2-3-12(25-13)16(21)22)6-27-7-15(26-17(14)27)19-8-20(23,9-19)10-19/h2-7,16H,8-10H2,1H3,(H,24,28)
InChIKeyCRHAEPUBIFTSAU-UHFFFAOYSA-N
MW402.38 g/mol
LogP4.07
Rot. Bonds5

About 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (PubChem CID 154655655) has the molecular formula C20H17F3N4O2 and a molecular weight of 402.38 g/mol. Its IUPAC name is 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
PubChem CID154655655
Molecular FormulaC20H17F3N4O2
Molecular Weight402.38 g/mol
Exact Mass402.13
IUPAC Name6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCOc1cc(NC(=O)c2cccc(C(F)F)n2)cn2cc(C34CC(F)(C3)C4)nc12
InChIInChI=1S/C20H17F3N4O2/c1-29-14-5-11(24-18(28)13-4-2-3-12(25-13)16(21)22)6-27-7-15(26-17(14)27)19-8-20(23,9-19)10-19/h2-7,16H,8-10H2,1H3,(H,24,28)
InChIKeyCRHAEPUBIFTSAU-UHFFFAOYSA-N
XLogP4.07
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.38
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide with MolForge

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Related Compounds

6-(difluoromethyl)-N-[2-[3-(difluoromethyl)-1-bicyclo[1.1.1]pentanyl]-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 154998330
6-(difluoromethyl)-N-[7-methoxy-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyrimidin-6-yl]pyridine-2-carboxamide
CID 154655651
6-(difluoromethyl)-N-(2-ethyl-8-fluoroimidazo[1,2-a]pyridin-6-yl)pyridine-2-carboxamide
CID 154655902
6-(difluoromethyl)-N-[2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
CID 154655612
N-(2-cyclopropyl-8-methoxyimidazo[1,2-a]pyrazin-6-yl)-6-(difluoromethyl)pyridine-2-carboxamide
CID 154655470
N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 154998188
6-(difluoromethyl)-N-[8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 154998213
N-[6-(difluoromethyl)-2-pyridinyl]-8-ethoxy-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide
CID 155437004
6-(difluoromethyl)-N-[7-ethoxy-2-[1-(hydroxymethyl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 1-[6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-7-ethoxyimidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxylate
CID 164993718
methyl 3-[6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-7-ethoxyimidazo[1,2-a]pyridin-2-yl]propanoate
CID 154655144
3-[2-[2-cyclopropyl-6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-3-fluoroimidazo[1,2-a]pyridin-7-yl]oxyethyl]-N-(2-cyclopropyl-8-ethoxyimidazo[1,2-a]pyridin-6-yl)-6-(difluoromethyl)pyridine-2-carboxamide
CID 155010163
6-(difluoromethyl)-N-[8-methoxy-2-(3-oxabicyclo[4.1.0]heptan-7-yl)imidazo[1,2-a]pyrazin-6-yl]pyridine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 154998256

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (CID 154655655) is 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is COc1cc(NC(=O)c2cccc(C(F)F)n2)cn2cc(C34CC(F)(C3)C4)nc12.
What is the InChIKey of 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The InChIKey is CRHAEPUBIFTSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F3N4O2/c1-29-14-5-11(24-18(28)13-4-2-3-12(25-13)16(21)22)6-27-7-15(26-17(14)27)19-8-20(23,9-19)10-19/h2-7,16H,8-10H2,1H3,(H,24,28).
What are the key properties of 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide has a molecular weight of 402.38 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-N-[2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 154655655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).