5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide

C21H19N5O — CID 155482160

IUPAC5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide
SMILESCc1c(C#N)cnc(C(=O)Nc2ccc3n[nH]c(/C=C/C4CC4)c3c2)c1C
InChIInChI=1S/C21H19N5O/c1-12-13(2)20(23-11-15(12)10-22)21(27)24-16-6-8-19-17(9-16)18(25-26-19)7-5-14-3-4-14/h5-9,11,14H,3-4H2,1-2H3,(H,24,27)(H,25,26)/b7-5+
InChIKeyOSKMGOBEJXCFBL-FNORWQNLSA-N
MW357.42 g/mol
LogP4.12
Rot. Bonds4

About 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide

5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide (PubChem CID 155482160) has the molecular formula C21H19N5O and a molecular weight of 357.42 g/mol. Its IUPAC name is 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide
PubChem CID155482160
Molecular FormulaC21H19N5O
Molecular Weight357.42 g/mol
Exact Mass357.16
IUPAC Name5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide
SMILESCc1c(C#N)cnc(C(=O)Nc2ccc3n[nH]c(/C=C/C4CC4)c3c2)c1C
InChIInChI=1S/C21H19N5O/c1-12-13(2)20(23-11-15(12)10-22)21(27)24-16-6-8-19-17(9-16)18(25-26-19)7-5-14-3-4-14/h5-9,11,14H,3-4H2,1-2H3,(H,24,27)(H,25,26)/b7-5+
InChIKeyOSKMGOBEJXCFBL-FNORWQNLSA-N
XLogP4.12
TPSA94.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.42
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide with MolForge

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Related Compounds

5-cyano-3,4-dimethyl-N-[3-(oxan-4-ylidenemethyl)-2H-indazol-5-yl]pyridine-2-carboxamide
CID 155482317
5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-1H-isoindol-5-yl]-3,4-dimethylpyridine-2-carboxamide
CID 167611840
5-cyano-N-(3-cyclopropyl-2H-indazol-5-yl)-3-methyl-4-(trifluoromethyl)pyridine-2-carboxamide
CID 155482385
N-[4-amino-3-[(E)-3-cyclopropylprop-2-enimidoyl]phenyl]-5-cyano-3,4-dimethylpyridine-2-carboxamide
CID 155481752
5-cyano-3,4-dimethyl-N-[3-[(E)-3,3,3-trifluoroprop-1-enyl]-1H-isoindol-5-yl]pyridine-2-carboxamide
CID 167683172
5-cyano-N-[3-(cyclopropanecarboximidoyl)-4-(iodophosphanylamino)phenyl]-3,4-dimethylpyridine-2-carboxamide
CID 155482749
N-(4-amino-3-fluoro-5-methanimidoylphenyl)-5-cyano-3,4-dimethylpyridine-2-carboxamide
CID 155482666
N-[4-amino-3-[(E)-4,4,4-trifluorobut-2-enimidoyl]phenyl]-5-cyano-3,4-dimethylpyridine-2-carboxamide
CID 155574887
5-cyano-4-methoxy-3-methyl-N-[3-(1,2-oxazol-4-yl)-1H-indazol-5-yl]pyridine-2-carboxamide
CID 155482655
4-chloro-5-cyano-3-methyl-N-(3-methyl-1H-isoindol-5-yl)pyridine-2-carboxamide
CID 167691136
5-cyano-3,4-dimethyl-N-[3-[(E)-prop-1-enyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indazol-5-yl]pyridine-2-carboxamide
CID 165436935
5-cyano-3,4-dimethyl-N-[4-(oxan-2-ylamino)-3-(pyrimidine-4-carboximidoyl)phenyl]pyridine-2-carboxamide
CID 155482263

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide?
The IUPAC name of 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide (CID 155482160) is 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide?
The canonical SMILES for 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide is Cc1c(C#N)cnc(C(=O)Nc2ccc3n[nH]c(/C=C/C4CC4)c3c2)c1C.
What is the InChIKey of 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide?
The InChIKey is OSKMGOBEJXCFBL-FNORWQNLSA-N. The full InChI is InChI=1S/C21H19N5O/c1-12-13(2)20(23-11-15(12)10-22)21(27)24-16-6-8-19-17(9-16)18(25-26-19)7-5-14-3-4-14/h5-9,11,14H,3-4H2,1-2H3,(H,24,27)(H,25,26)/b7-5+.
What are the key properties of 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide?
5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide has a molecular weight of 357.42 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-[3-[(E)-2-cyclopropylethenyl]-2H-indazol-5-yl]-3,4-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 155482160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).