N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide

C21H19N5O — CID 141140513

IUPACN-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide
SMILESCn1cc2ccc(NC(=O)c3ccccc3NCc3ccncc3)cc2n1
InChIInChI=1S/C21H19N5O/c1-26-14-16-6-7-17(12-20(16)25-26)24-21(27)18-4-2-3-5-19(18)23-13-15-8-10-22-11-9-15/h2-12,14,23H,13H2,1H3,(H,24,27)
InChIKeyYSACIYBAKVPFEA-UHFFFAOYSA-N
MW357.42 g/mol
LogP3.83
Rot. Bonds5

About N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide

N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide (PubChem CID 141140513) has the molecular formula C21H19N5O and a molecular weight of 357.42 g/mol. Its IUPAC name is N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide.

Molecular Properties

Compound NameN-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide
PubChem CID141140513
Molecular FormulaC21H19N5O
Molecular Weight357.42 g/mol
Exact Mass357.16
IUPAC NameN-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide
SMILESCn1cc2ccc(NC(=O)c3ccccc3NCc3ccncc3)cc2n1
InChIInChI=1S/C21H19N5O/c1-26-14-16-6-7-17(12-20(16)25-26)24-21(27)18-4-2-3-5-19(18)23-13-15-8-10-22-11-9-15/h2-12,14,23H,13H2,1H3,(H,24,27)
InChIKeyYSACIYBAKVPFEA-UHFFFAOYSA-N
XLogP3.83
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.42
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-bromo-4-pyridinyl)methylamino]-N-(2-methylindazol-6-yl)benzamide
CID 23118972
[4-[[2-[(2-methylindazol-6-yl)carbamoyl]anilino]methyl]-2-pyridinyl] hydrogen carbonate
CID 68886794
2-[[2-(dimethylcarbamoylamino)-4-pyridinyl]methylamino]-N-(4-fluoro-2-methylindazol-6-yl)benzamide
CID 11561691
2-[(2-amino-4-pyridinyl)methylamino]-N-(1-methylindazol-6-yl)benzamide
CID 68820475
N-[2-(2-methoxyethyl)indazol-5-yl]-2-[[2-(methylcarbamoylamino)-4-pyridinyl]methylamino]benzamide
CID 68820057
N-[2-(aminomethyl)phenyl]-2-(pyridin-4-ylmethylamino)benzamide
CID 174430362
2-methyl-N-[4-(pyridin-4-ylmethylamino)phenyl]benzamide
CID 112983118
N-[4-(1-cyanocyclopropyl)phenyl]-2-(pyridin-4-ylmethylamino)benzamide
CID 11326111
2-(pyridin-4-ylmethylamino)benzoate
CID 3280709
N-pent-2-en-3-yloxy-2-(pyridin-4-ylmethylamino)benzamide
CID 91322862
N-(2,2,3,3,6-pentafluoro-1,4-benzodioxin-7-yl)-2-(pyridin-4-ylmethylamino)benzamide
CID 59848948
N-(3-phenylpropyl)-2-(pyridin-4-ylmethylamino)benzamide
CID 15462164

Frequently Asked Questions

What is the IUPAC name of N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide?
The IUPAC name of N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide (CID 141140513) is N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide.
What is the SMILES notation for N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide?
The canonical SMILES for N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide is Cn1cc2ccc(NC(=O)c3ccccc3NCc3ccncc3)cc2n1.
What is the InChIKey of N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide?
The InChIKey is YSACIYBAKVPFEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O/c1-26-14-16-6-7-17(12-20(16)25-26)24-21(27)18-4-2-3-5-19(18)23-13-15-8-10-22-11-9-15/h2-12,14,23H,13H2,1H3,(H,24,27).
What are the key properties of N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide?
N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide has a molecular weight of 357.42 g/mol, XLogP of 3.83, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylindazol-6-yl)-2-(pyridin-4-ylmethylamino)benzamide is sourced from PubChem (CID 141140513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).