2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide

C22H24N6O2 — CID 118226534

IUPAC2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide
SMILESCc1cc(-c2nc(C(=O)NC3=CC4=CN(C)NC4C=C3N3CCCC3)co2)ccn1
InChIInChI=1S/C22H24N6O2/c1-14-9-15(5-6-23-14)22-25-19(13-30-22)21(29)24-18-10-16-12-27(2)26-17(16)11-20(18)28-7-3-4-8-28/h5-6,9-13,17,26H,3-4,7-8H2,1-2H3,(H,24,29)
InChIKeyNHYSWMXTGXFRNQ-UHFFFAOYSA-N
MW404.47 g/mol
LogP2.35
Rot. Bonds4

About 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide

2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide (PubChem CID 118226534) has the molecular formula C22H24N6O2 and a molecular weight of 404.47 g/mol. Its IUPAC name is 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide
PubChem CID118226534
Molecular FormulaC22H24N6O2
Molecular Weight404.47 g/mol
Exact Mass404.20
IUPAC Name2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide
SMILESCc1cc(-c2nc(C(=O)NC3=CC4=CN(C)NC4C=C3N3CCCC3)co2)ccn1
InChIInChI=1S/C22H24N6O2/c1-14-9-15(5-6-23-14)22-25-19(13-30-22)21(29)24-18-10-16-12-27(2)26-17(16)11-20(18)28-7-3-4-8-28/h5-6,9-13,17,26H,3-4,7-8H2,1-2H3,(H,24,29)
InChIKeyNHYSWMXTGXFRNQ-UHFFFAOYSA-N
XLogP2.35
TPSA86.53 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-amino-5-(methyliminomethyl)-2-pyrrolidin-1-ylphenyl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 138457202
N-[6-(3-hydroxypyrrolidin-1-yl)-1-methylindazol-5-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 118226651
N-[5-(azepan-1-yl)-2-morpholin-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 175460563
N-[6-(cyclohexylamino)-2-methylindazol-5-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 144883766
N-[2-[(6R)-2-hydroxy-2,6-dimethylmorpholin-4-yl]-5-piperidin-1-yl-[1,3]thiazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 130339798
N-[3-carbamoyl-1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;ethane
CID 161237860
N-(6-methoxy-2-propan-2-ylindazol-5-yl)-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 176724064
N-[6-(4-hydroxypiperidin-1-yl)-1-(2-methoxyethyl)indazol-5-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 118226751
N-[5-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;hydrochloride
CID 118224222
N-[1-cyclohexyl-3-(methylcarbamoyl)pyrazol-4-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;ethane
CID 158415687
N-[6-(4-hydroxypiperidin-1-yl)-1-(3-methoxypropyl)indazol-5-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;hydrochloride
CID 162329642
N-[1-ethyl-5-[(3S)-3-hydroxypyrrolidin-1-yl]indazol-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 118608558

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide (CID 118226534) is 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide is Cc1cc(-c2nc(C(=O)NC3=CC4=CN(C)NC4C=C3N3CCCC3)co2)ccn1.
What is the InChIKey of 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide?
The InChIKey is NHYSWMXTGXFRNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6O2/c1-14-9-15(5-6-23-14)22-25-19(13-30-22)21(29)24-18-10-16-12-27(2)26-17(16)11-20(18)28-7-3-4-8-28/h5-6,9-13,17,26H,3-4,7-8H2,1-2H3,(H,24,29).
What are the key properties of 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide?
2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide has a molecular weight of 404.47 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-4-pyridinyl)-N-(2-methyl-6-pyrrolidin-1-yl-1,7a-dihydroindazol-5-yl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 118226534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).