N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride

C23H26ClN7O2 — CID 118226741

IUPACN-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride
SMILESCl.Cn1cc2cc(NC(=O)c3cccc(-c4cn[nH]c4)n3)c(N3CCC(CO)CC3)cc2n1
InChIInChI=1S/C23H25N7O2.ClH/c1-29-13-16-9-21(22(10-20(16)28-29)30-7-5-15(14-31)6-8-30)27-23(32)19-4-2-3-18(26-19)17-11-24-25-12-17;/h2-4,9-13,15,31H,5-8,14H2,1H3,(H,24,25)(H,27,32);1H
InChIKeyLKWRWYSEHNNYMI-UHFFFAOYSA-N
MW467.96 g/mol
LogP3.24
Rot. Bonds5

About N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride

N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride (PubChem CID 118226741) has the molecular formula C23H26ClN7O2 and a molecular weight of 467.96 g/mol. Its IUPAC name is N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride
PubChem CID118226741
Molecular FormulaC23H26ClN7O2
Molecular Weight467.96 g/mol
Exact Mass467.18
IUPAC NameN-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride
SMILESCl.Cn1cc2cc(NC(=O)c3cccc(-c4cn[nH]c4)n3)c(N3CCC(CO)CC3)cc2n1
InChIInChI=1S/C23H25N7O2.ClH/c1-29-13-16-9-21(22(10-20(16)28-29)30-7-5-15(14-31)6-8-30)27-23(32)19-4-2-3-18(26-19)17-11-24-25-12-17;/h2-4,9-13,15,31H,5-8,14H2,1H3,(H,24,25)(H,27,32);1H
InChIKeyLKWRWYSEHNNYMI-UHFFFAOYSA-N
XLogP3.24
TPSA111.96 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.96
LogP ≤ 53.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

N-(6-cyclopropyl-2-methylindazol-5-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
CID 118226676
6-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide
CID 118233202
N-[3-(5-bromopentylcarbamoyl)-1-methylpyrazol-4-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
CID 131749100
N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
CID 134450354
N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-2-(2-methoxy-4-pyridinyl)-4,5-dihydro-1,3-oxazole-4-carboxamide
CID 163578868
4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride
CID 135221404
N-[1-cyclohexyl-3-(3,5-difluoro-2-pyridinyl)pyrazol-4-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
CID 142338646
N-(2-methyl-6-piperidin-1-ylindazol-5-yl)-2-(3-methylpyrrolidin-1-yl)-1,3-oxazole-4-carboxamide
CID 123930185
N-[2-[2-(4-benzoylpiperazin-1-yl)-2-oxoethyl]indazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
CID 118182513
N-[2-[2-[2-(methylamino)ethylamino]-2-oxoethyl]indazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
CID 134422733
N-[2-[4-(1-iodoethyl)cyclohexyl]-6-methoxyindazol-5-yl]-6-(1-methylpyrazol-4-yl)pyridine-2-carboxamide
CID 155449126
6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide
CID 155438263

Frequently Asked Questions

What is the IUPAC name of N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride?
The IUPAC name of N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride (CID 118226741) is N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride is Cl.Cn1cc2cc(NC(=O)c3cccc(-c4cn[nH]c4)n3)c(N3CCC(CO)CC3)cc2n1.
What is the InChIKey of N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride?
The InChIKey is LKWRWYSEHNNYMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N7O2.ClH/c1-29-13-16-9-21(22(10-20(16)28-29)30-7-5-15(14-31)6-8-30)27-23(32)19-4-2-3-18(26-19)17-11-24-25-12-17;/h2-4,9-13,15,31H,5-8,14H2,1H3,(H,24,25)(H,27,32);1H.
What are the key properties of N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride?
N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride has a molecular weight of 467.96 g/mol, XLogP of 3.24, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-methylindazol-5-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide;hydrochloride is sourced from PubChem (CID 118226741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).