6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide

C19H16N6OS — CID 162424199

IUPAC6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide
SMILESCc1nc(N)sc1-c1ccc2c(/C=C/c3ccccn3)nn(C(N)=O)c2c1
InChIInChI=1S/C19H16N6OS/c1-11-17(27-18(20)23-11)12-5-7-14-15(8-6-13-4-2-3-9-22-13)24-25(19(21)26)16(14)10-12/h2-10H,1H3,(H2,20,23)(H2,21,26)/b8-6+
InChIKeyPDJZCWMZEWLVLW-SOFGYWHQSA-N
MW376.45 g/mol
LogP3.54
Rot. Bonds3

About 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide

6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide (PubChem CID 162424199) has the molecular formula C19H16N6OS and a molecular weight of 376.45 g/mol. Its IUPAC name is 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide.

Molecular Properties

Compound Name6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide
PubChem CID162424199
Molecular FormulaC19H16N6OS
Molecular Weight376.45 g/mol
Exact Mass376.11
IUPAC Name6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide
SMILESCc1nc(N)sc1-c1ccc2c(/C=C/c3ccccn3)nn(C(N)=O)c2c1
InChIInChI=1S/C19H16N6OS/c1-11-17(27-18(20)23-11)12-5-7-14-15(8-6-13-4-2-3-9-22-13)24-25(19(21)26)16(14)10-12/h2-10H,1H3,(H2,20,23)(H2,21,26)/b8-6+
InChIKeyPDJZCWMZEWLVLW-SOFGYWHQSA-N
XLogP3.54
TPSA112.71 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.45
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide?
The IUPAC name of 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide (CID 162424199) is 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide.
What is the SMILES notation for 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide?
The canonical SMILES for 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide is Cc1nc(N)sc1-c1ccc2c(/C=C/c3ccccn3)nn(C(N)=O)c2c1.
What is the InChIKey of 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide?
The InChIKey is PDJZCWMZEWLVLW-SOFGYWHQSA-N. The full InChI is InChI=1S/C19H16N6OS/c1-11-17(27-18(20)23-11)12-5-7-14-15(8-6-13-4-2-3-9-22-13)24-25(19(21)26)16(14)10-12/h2-10H,1H3,(H2,20,23)(H2,21,26)/b8-6+.
What are the key properties of 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide?
6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide has a molecular weight of 376.45 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazole-1-carboxamide is sourced from PubChem (CID 162424199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).