3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one

C23H19ClFN7O — CID 157183075

IUPAC3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one
SMILESO=C(CCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2cc3cc(C4CC4)ccn3n2)nn1
InChIInChI=1S/C23H19ClFN7O/c24-18-6-7-30-13-26-19(23(30)22(18)25)3-4-21(33)20-12-31(29-27-20)11-16-10-17-9-15(14-1-2-14)5-8-32(17)28-16/h5-10,12-14H,1-4,11H2
InChIKeyCUVZVJYFJMAUAQ-UHFFFAOYSA-N
MW463.90 g/mol
LogP4.11
Rot. Bonds7

About 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one

3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one (PubChem CID 157183075) has the molecular formula C23H19ClFN7O and a molecular weight of 463.90 g/mol. Its IUPAC name is 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one.

Molecular Properties

Compound Name3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one
PubChem CID157183075
Molecular FormulaC23H19ClFN7O
Molecular Weight463.90 g/mol
Exact Mass463.13
IUPAC Name3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one
SMILESO=C(CCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2cc3cc(C4CC4)ccn3n2)nn1
InChIInChI=1S/C23H19ClFN7O/c24-18-6-7-30-13-26-19(23(30)22(18)25)3-4-21(33)20-12-31(29-27-20)11-16-10-17-9-15(14-1-2-14)5-8-32(17)28-16/h5-10,12-14H,1-4,11H2
InChIKeyCUVZVJYFJMAUAQ-UHFFFAOYSA-N
XLogP4.11
TPSA82.38 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.90
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;pyrrolidine
CID 158129301
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-7-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide
CID 139488013
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide
CID 153431040
2-[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxyacetic acid
CID 139487408
6-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-3-cyclopropyl-N-methylquinoline-8-carboxamide
CID 153343983
3-[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]-3-hydroxy-2,2-dimethylpropanoic acid
CID 139487275
lithium;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;N-(2-oxoethyl)formamide;hydroxide
CID 158609138
1-[[8-(2-aminoethoxymethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]-N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]triazole-4-carboxamide
CID 139487545
lithium;2-[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-5-cyclopropylindol-1-yl]acetic acid;methyl 2-[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-5-cyclopropylindol-1-yl]acetate;hydroxide;hydrate
CID 157480407
2-[[5-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]-1,3,4-oxadiazol-2-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile
CID 160672678
methyl 1-[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-b]pyridazin-8-yl]azetidine-3-carboxylate
CID 139487530
N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-([1,2,4]triazolo[1,5-a]pyridin-2-ylmethyl)triazole-4-carboxamide
CID 139487736

Frequently Asked Questions

What is the IUPAC name of 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one?
The IUPAC name of 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one (CID 157183075) is 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one.
What is the SMILES notation for 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one?
The canonical SMILES for 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one is O=C(CCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2cc3cc(C4CC4)ccn3n2)nn1.
What is the InChIKey of 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one?
The InChIKey is CUVZVJYFJMAUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClFN7O/c24-18-6-7-30-13-26-19(23(30)22(18)25)3-4-21(33)20-12-31(29-27-20)11-16-10-17-9-15(14-1-2-14)5-8-32(17)28-16/h5-10,12-14H,1-4,11H2.
What are the key properties of 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one?
3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one has a molecular weight of 463.90 g/mol, XLogP of 4.11, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[(5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazol-4-yl]propan-1-one is sourced from PubChem (CID 157183075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).