2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride

C23H26ClN7O2 — CID 118226407

IUPAC2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride
SMILESCNc1cc(-c2nc(C(=O)Nc3cc4cn(C)nc4cc3N3CCCCC3)co2)ccn1.Cl
InChIInChI=1S/C23H25N7O2.ClH/c1-24-21-11-15(6-7-25-21)23-27-19(14-32-23)22(31)26-18-10-16-13-29(2)28-17(16)12-20(18)30-8-4-3-5-9-30;/h6-7,10-14H,3-5,8-9H2,1-2H3,(H,24,25)(H,26,31);1H
InChIKeyKKSQQCKAYHVYPJ-UHFFFAOYSA-N
MW467.96 g/mol
LogP4.33
Rot. Bonds5

About 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride

2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride (PubChem CID 118226407) has the molecular formula C23H26ClN7O2 and a molecular weight of 467.96 g/mol. Its IUPAC name is 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride
PubChem CID118226407
Molecular FormulaC23H26ClN7O2
Molecular Weight467.96 g/mol
Exact Mass467.18
IUPAC Name2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride
SMILESCNc1cc(-c2nc(C(=O)Nc3cc4cn(C)nc4cc3N3CCCCC3)co2)ccn1.Cl
InChIInChI=1S/C23H25N7O2.ClH/c1-24-21-11-15(6-7-25-21)23-27-19(14-32-23)22(31)26-18-10-16-13-29(2)28-17(16)12-20(18)30-8-4-3-5-9-30;/h6-7,10-14H,3-5,8-9H2,1-2H3,(H,24,25)(H,26,31);1H
InChIKeyKKSQQCKAYHVYPJ-UHFFFAOYSA-N
XLogP4.33
TPSA101.11 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.96
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride with MolForge

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Related Compounds

2-(2-methoxy-4-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide
CID 118226401
N-[6-(cyclohexylamino)-2-methylindazol-5-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 144883766
4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride
CID 135221404
N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-2-(3-methylpyrrolidin-1-yl)-1,3-oxazole-4-carboxamide
CID 123930185
N-(3-carbamoyl-1-methylpyrazol-4-yl)-2-[2-(cyclopropylmethylamino)-4-pyridinyl]-1,3-oxazole-4-carboxamide
CID 52913876
2-(2-acetamido-4-pyridinyl)-N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide
CID 170361497
N-[4-amino-5-(methyliminomethyl)-2-pyrrolidin-1-ylphenyl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 138457202
N-[1-methyl-3-[5-(methylaminomethyl)-2-oxo-1,3-oxazolidin-3-yl]pyrazol-4-yl]-2-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]-1,3-oxazole-4-carboxamide
CID 118060838
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-[6-(4-hydroxypiperidin-1-yl)-1-(2-methoxyethyl)indazol-5-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 118226751
N-[3-(3,3-dimethyl-2-oxopyrrolidin-1-yl)-1-methylpyrazol-4-yl]-2-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]-1,3-oxazole-4-carboxamide;hydrochloride
CID 118061048
6-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide
CID 118233202

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride?
The IUPAC name of 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride (CID 118226407) is 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride.
What is the SMILES notation for 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride?
The canonical SMILES for 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride is CNc1cc(-c2nc(C(=O)Nc3cc4cn(C)nc4cc3N3CCCCC3)co2)ccn1.Cl.
What is the InChIKey of 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride?
The InChIKey is KKSQQCKAYHVYPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N7O2.ClH/c1-24-21-11-15(6-7-25-21)23-27-19(14-32-23)22(31)26-18-10-16-13-29(2)28-17(16)12-20(18)30-8-4-3-5-9-30;/h6-7,10-14H,3-5,8-9H2,1-2H3,(H,24,25)(H,26,31);1H.
What are the key properties of 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride?
2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride has a molecular weight of 467.96 g/mol, XLogP of 4.33, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)-4-pyridinyl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-1,3-oxazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 118226407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).