4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride

C24H26ClN7O — CID 135221404

IUPAC4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride
SMILESCl.Cn1cc2cc(NC(=O)c3cc(-c4ccc(N)nc4)ccn3)c(N3CCCCC3)cc2n1
InChIInChI=1S/C24H25N7O.ClH/c1-30-15-18-12-20(22(13-19(18)29-30)31-9-3-2-4-10-31)28-24(32)21-11-16(7-8-26-21)17-5-6-23(25)27-14-17;/h5-8,11-15H,2-4,9-10H2,1H3,(H2,25,27)(H,28,32);1H
InChIKeyNYIWMTHNSLYBSG-UHFFFAOYSA-N
MW463.97 g/mol
LogP4.28
Rot. Bonds4

About 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride

4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride (PubChem CID 135221404) has the molecular formula C24H26ClN7O and a molecular weight of 463.97 g/mol. Its IUPAC name is 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride
PubChem CID135221404
Molecular FormulaC24H26ClN7O
Molecular Weight463.97 g/mol
Exact Mass463.19
IUPAC Name4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride
SMILESCl.Cn1cc2cc(NC(=O)c3cc(-c4ccc(N)nc4)ccn3)c(N3CCCCC3)cc2n1
InChIInChI=1S/C24H25N7O.ClH/c1-30-15-18-12-20(22(13-19(18)29-30)31-9-3-2-4-10-31)28-24(32)21-11-16(7-8-26-21)17-5-6-23(25)27-14-17;/h5-8,11-15H,2-4,9-10H2,1H3,(H2,25,27)(H,28,32);1H
InChIKeyNYIWMTHNSLYBSG-UHFFFAOYSA-N
XLogP4.28
TPSA101.96 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms33
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.97
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride?
The IUPAC name of 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride (CID 135221404) is 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride.
What is the SMILES notation for 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride?
The canonical SMILES for 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride is Cl.Cn1cc2cc(NC(=O)c3cc(-c4ccc(N)nc4)ccn3)c(N3CCCCC3)cc2n1.
What is the InChIKey of 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride?
The InChIKey is NYIWMTHNSLYBSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N7O.ClH/c1-30-15-18-12-20(22(13-19(18)29-30)31-9-3-2-4-10-31)28-24(32)21-11-16(7-8-26-21)17-5-6-23(25)27-14-17;/h5-8,11-15H,2-4,9-10H2,1H3,(H2,25,27)(H,28,32);1H.
What are the key properties of 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride?
4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride has a molecular weight of 463.97 g/mol, XLogP of 4.28, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-amino-3-pyridinyl)-N-(2-methyl-6-piperidin-1-ylindazol-5-yl)pyridine-2-carboxamide;hydrochloride is sourced from PubChem (CID 135221404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).