N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide

C23H18ClFN6O2 — CID 139488201

IUPACN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
SMILESO=C(NCc1ncn2ccc(Cl)c(F)c12)c1coc(Cc2cn3cc(C4CC4)ccc3n2)n1
InChIInChI=1S/C23H18ClFN6O2/c24-16-5-6-30-12-27-17(22(30)21(16)25)8-26-23(32)18-11-33-20(29-18)7-15-10-31-9-14(13-1-2-13)3-4-19(31)28-15/h3-6,9-13H,1-2,7-8H2,(H,26,32)
InChIKeyFZDKJKILBJBBHB-UHFFFAOYSA-N
MW464.89 g/mol
LogP4.16
Rot. Bonds6

About N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide

N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide (PubChem CID 139488201) has the molecular formula C23H18ClFN6O2 and a molecular weight of 464.89 g/mol. Its IUPAC name is N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
PubChem CID139488201
Molecular FormulaC23H18ClFN6O2
Molecular Weight464.89 g/mol
Exact Mass464.12
IUPAC NameN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
SMILESO=C(NCc1ncn2ccc(Cl)c(F)c12)c1coc(Cc2cn3cc(C4CC4)ccc3n2)n1
InChIInChI=1S/C23H18ClFN6O2/c24-16-5-6-30-12-27-17(22(30)21(16)25)8-26-23(32)18-11-33-20(29-18)7-15-10-31-9-14(13-1-2-13)3-4-19(31)28-15/h3-6,9-13H,1-2,7-8H2,(H,26,32)
InChIKeyFZDKJKILBJBBHB-UHFFFAOYSA-N
XLogP4.16
TPSA89.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.89
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide with MolForge

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Related Compounds

Ethyl 4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-2-carboxylate
CID 139488252
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide
CID 139488401
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide
CID 139488297
N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide
CID 139487477
[4-[[2-(4-Chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(1,3-oxazol-4-yl)methanone
CID 121309778
US11098063, Example 47
CID 149233070
4-amino-2-[6-chloro-3-(3,3,4,4,4-pentafluorobutyl)imidazo[1,5-a]pyridin-1-yl]-5-methyl-5-(2-methyl-1,3-oxazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-6-one
CID 54675551
4-amino-2-[6-chloro-3-(3,3,4,4,4-pentafluorobutyl)imidazo[1,5-a]pyridin-1-yl]-5-methyl-5-(5-methyl-1,3-oxazol-2-yl)-7H-pyrrolo[2,3-d]pyrimidin-6-one
CID 89438415
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(Z)-2-(dimethylamino)-3-(ethenylamino)prop-2-enyl]-1,3-oxazole-4-carboxamide
CID 155180326
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-ethoxyimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide
CID 164121076
2-[2-[2-[6-(4-chlorophenyl)-1H-benzimidazol-2-yl]ethylamino]ethyl]-N-[(3-fluoro-2-pyridinyl)methyl]-1,3-oxazole-4-carboxamide
CID 166083849
2-[2-[2-[6-(3-chlorophenyl)-1H-benzimidazol-2-yl]ethylamino]ethyl]-N-[(3-fluoro-2-pyridinyl)methyl]-1,3-oxazole-4-carboxamide
CID 166083865

Frequently Asked Questions

What is the IUPAC name of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide (CID 139488201) is N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide is O=C(NCc1ncn2ccc(Cl)c(F)c12)c1coc(Cc2cn3cc(C4CC4)ccc3n2)n1.
What is the InChIKey of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is FZDKJKILBJBBHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18ClFN6O2/c24-16-5-6-30-12-27-17(22(30)21(16)25)8-26-23(32)18-11-33-20(29-18)7-15-10-31-9-14(13-1-2-13)3-4-19(31)28-15/h3-6,9-13H,1-2,7-8H2,(H,26,32).
What are the key properties of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide?
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 464.89 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-2-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 139488201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).