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N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide

C26H22ClFN8O3 — CID 139488054

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPACN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide
SMILESO=C(NCc1ncn2ccc(Cl)c(F)c12)c1cnn(Cc2cn3cc(C4CC4)cc(N4CCOC4=O)c3n2)c1
InChIInChI=1S/C26H22ClFN8O3/c27-19-3-4-33-14-30-20(23(33)22(19)28)9-29-25(37)17-8-31-35(11-17)13-18-12-34-10-16(15-1-2-15)7-21(24(34)32-18)36-5-6-39-26(36)38/h3-4,7-8,10-12,14-15H,1-2,5-6,9,13H2,(H,29,37)
InChIKeyUDNOQAKXPGDOAP-UHFFFAOYSA-N
MW548.97 g/mol
LogP3.78
Rot. Bonds7

About N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide

N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide (PubChem CID 139488054) has the molecular formula C26H22ClFN8O3 and a molecular weight of 548.97 g/mol. Its IUPAC name is N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide
PubChem CID139488054
Molecular FormulaC26H22ClFN8O3
Molecular Weight548.97 g/mol
Exact Mass548.15
IUPAC NameN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide
SMILESO=C(NCc1ncn2ccc(Cl)c(F)c12)c1cnn(Cc2cn3cc(C4CC4)cc(N4CCOC4=O)c3n2)c1
InChIInChI=1S/C26H22ClFN8O3/c27-19-3-4-33-14-30-20(23(33)22(19)28)9-29-25(37)17-8-31-35(11-17)13-18-12-34-10-16(15-1-2-15)7-21(24(34)32-18)36-5-6-39-26(36)38/h3-4,7-8,10-12,14-15H,1-2,5-6,9,13H2,(H,29,37)
InChIKeyUDNOQAKXPGDOAP-UHFFFAOYSA-N
XLogP3.78
TPSA111.06 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500548.97
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide?
The IUPAC name of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide (CID 139488054) is N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide.
What is the SMILES notation for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide?
The canonical SMILES for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide is O=C(NCc1ncn2ccc(Cl)c(F)c12)c1cnn(Cc2cn3cc(C4CC4)cc(N4CCOC4=O)c3n2)c1.
What is the InChIKey of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide?
The InChIKey is UDNOQAKXPGDOAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22ClFN8O3/c27-19-3-4-33-14-30-20(23(33)22(19)28)9-29-25(37)17-8-31-35(11-17)13-18-12-34-10-16(15-1-2-15)7-21(24(34)32-18)36-5-6-39-26(36)38/h3-4,7-8,10-12,14-15H,1-2,5-6,9,13H2,(H,29,37).
What are the key properties of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide?
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide has a molecular weight of 548.97 g/mol, XLogP of 3.78, 7 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-oxo-1,3-oxazolidin-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazole-4-carboxamide is sourced from PubChem (CID 139488054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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