N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide

C24H20ClFN6O3 — CID 175682520

IUPACN-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(Nc1cc(-c2noc([C@H]3C[C@@H]3F)n2)ccc1Cl)c1cnn2ccc(N3CC4(COC4)C3)cc12
InChIInChI=1S/C24H20ClFN6O3/c25-17-2-1-13(21-29-23(35-30-21)15-7-18(15)26)5-19(17)28-22(33)16-8-27-32-4-3-14(6-20(16)32)31-9-24(10-31)11-34-12-24/h1-6,8,15,18H,7,9-12H2,(H,28,33)/t15-,18-/m0/s1
InChIKeyJQLUFBKYRYQQBM-YJBOKZPZSA-N
MW494.91 g/mol
LogP3.95
Rot. Bonds5

About N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide

N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 175682520) has the molecular formula C24H20ClFN6O3 and a molecular weight of 494.91 g/mol. Its IUPAC name is N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID175682520
Molecular FormulaC24H20ClFN6O3
Molecular Weight494.91 g/mol
Exact Mass494.13
IUPAC NameN-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(Nc1cc(-c2noc([C@H]3C[C@@H]3F)n2)ccc1Cl)c1cnn2ccc(N3CC4(COC4)C3)cc12
InChIInChI=1S/C24H20ClFN6O3/c25-17-2-1-13(21-29-23(35-30-21)15-7-18(15)26)5-19(17)28-22(33)16-8-27-32-4-3-14(6-20(16)32)31-9-24(10-31)11-34-12-24/h1-6,8,15,18H,7,9-12H2,(H,28,33)/t15-,18-/m0/s1
InChIKeyJQLUFBKYRYQQBM-YJBOKZPZSA-N
XLogP3.95
TPSA97.79 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500494.91
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide (CID 175682520) is N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide is O=C(Nc1cc(-c2noc([C@H]3C[C@@H]3F)n2)ccc1Cl)c1cnn2ccc(N3CC4(COC4)C3)cc12.
What is the InChIKey of N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is JQLUFBKYRYQQBM-YJBOKZPZSA-N. The full InChI is InChI=1S/C24H20ClFN6O3/c25-17-2-1-13(21-29-23(35-30-21)15-7-18(15)26)5-19(17)28-22(33)16-8-27-32-4-3-14(6-20(16)32)31-9-24(10-31)11-34-12-24/h1-6,8,15,18H,7,9-12H2,(H,28,33)/t15-,18-/m0/s1.
What are the key properties of N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide?
N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 494.91 g/mol, XLogP of 3.95, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-[5-[(1R,2S)-2-fluorocyclopropyl]-1,2,4-oxadiazol-3-yl]phenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 175682520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).