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

C24H17ClFN7O2 — CID 177296682

IUPACN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide
SMILESN#Cc1cc(C2CC2)cn2cc(Cc3nnc(C(=O)NCc4ncn5ccc(Cl)c(F)c45)o3)cc12
InChIInChI=1S/C24H17ClFN7O2/c25-17-3-4-32-12-29-18(22(32)21(17)26)9-28-23(34)24-31-30-20(35-24)6-13-5-19-15(8-27)7-16(14-1-2-14)11-33(19)10-13/h3-5,7,10-12,14H,1-2,6,9H2,(H,28,34)
InChIKeyQXHADSBRIZSFIG-UHFFFAOYSA-N
MW489.90 g/mol
LogP4.03
Rot. Bonds6

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

N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide (PubChem CID 177296682) has the molecular formula C24H17ClFN7O2 and a molecular weight of 489.90 g/mol. Its IUPAC name is N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide.

Molecular Properties

Compound NameN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide
PubChem CID177296682
Molecular FormulaC24H17ClFN7O2
Molecular Weight489.90 g/mol
Exact Mass489.11
IUPAC NameN-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide
SMILESN#Cc1cc(C2CC2)cn2cc(Cc3nnc(C(=O)NCc4ncn5ccc(Cl)c(F)c45)o3)cc12
InChIInChI=1S/C24H17ClFN7O2/c25-17-3-4-32-12-29-18(22(32)21(17)26)9-28-23(34)24-31-30-20(35-24)6-13-5-19-15(8-27)7-16(14-1-2-14)11-33(19)10-13/h3-5,7,10-12,14H,1-2,6,9H2,(H,28,34)
InChIKeyQXHADSBRIZSFIG-UHFFFAOYSA-N
XLogP4.03
TPSA113.52 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.90
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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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]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide?
The IUPAC name of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide (CID 177296682) is N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide.
What is the SMILES notation for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide?
The canonical SMILES for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide is N#Cc1cc(C2CC2)cn2cc(Cc3nnc(C(=O)NCc4ncn5ccc(Cl)c(F)c45)o3)cc12.
What is the InChIKey of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide?
The InChIKey is QXHADSBRIZSFIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17ClFN7O2/c25-17-3-4-32-12-29-18(22(32)21(17)26)9-28-23(34)24-31-30-20(35-24)6-13-5-19-15(8-27)7-16(14-1-2-14)11-33(19)10-13/h3-5,7,10-12,14H,1-2,6,9H2,(H,28,34).
What are the key properties of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide?
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide has a molecular weight of 489.90 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide is sourced from PubChem (CID 177296682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).