6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide

C23H24N6O4 — CID 175927204

IUPAC6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide
SMILESCOc1cc2[nH]ncc2c(C2(c3nnco3)CCCCC2)c1C(=O)Nc1cccn(C)c1=O
InChIInChI=1S/C23H24N6O4/c1-29-10-6-7-15(21(29)31)26-20(30)18-17(32-2)11-16-14(12-24-27-16)19(18)23(8-4-3-5-9-23)22-28-25-13-33-22/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,24,27)(H,26,30)
InChIKeyXXILDAQJJQOZKF-UHFFFAOYSA-N
MW448.48 g/mol
LogP3.16
Rot. Bonds5

About 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide

6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide (PubChem CID 175927204) has the molecular formula C23H24N6O4 and a molecular weight of 448.48 g/mol. Its IUPAC name is 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide
PubChem CID175927204
Molecular FormulaC23H24N6O4
Molecular Weight448.48 g/mol
Exact Mass448.19
IUPAC Name6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide
SMILESCOc1cc2[nH]ncc2c(C2(c3nnco3)CCCCC2)c1C(=O)Nc1cccn(C)c1=O
InChIInChI=1S/C23H24N6O4/c1-29-10-6-7-15(21(29)31)26-20(30)18-17(32-2)11-16-14(12-24-27-16)19(18)23(8-4-3-5-9-23)22-28-25-13-33-22/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,24,27)(H,26,30)
InChIKeyXXILDAQJJQOZKF-UHFFFAOYSA-N
XLogP3.16
TPSA127.93 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.48
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide?
The IUPAC name of 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide (CID 175927204) is 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide.
What is the SMILES notation for 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide?
The canonical SMILES for 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide is COc1cc2[nH]ncc2c(C2(c3nnco3)CCCCC2)c1C(=O)Nc1cccn(C)c1=O.
What is the InChIKey of 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide?
The InChIKey is XXILDAQJJQOZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O4/c1-29-10-6-7-15(21(29)31)26-20(30)18-17(32-2)11-16-14(12-24-27-16)19(18)23(8-4-3-5-9-23)22-28-25-13-33-22/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,24,27)(H,26,30).
What are the key properties of 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide?
6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide has a molecular weight of 448.48 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-4-[1-(1,3,4-oxadiazol-2-yl)cyclohexyl]-1H-indazole-5-carboxamide is sourced from PubChem (CID 175927204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).