2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide

C20H18N6O2S — CID 59332392

IUPAC2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cnccc1N1CCOCC1)c1csc(-n2ncc3ccccc32)n1
InChIInChI=1S/C20H18N6O2S/c27-19(23-15-12-21-6-5-18(15)25-7-9-28-10-8-25)16-13-29-20(24-16)26-17-4-2-1-3-14(17)11-22-26/h1-6,11-13H,7-10H2,(H,23,27)
InChIKeyYBTPWOCMWKWAMW-UHFFFAOYSA-N
MW406.47 g/mol
LogP2.97
Rot. Bonds4

About 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide

2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide (PubChem CID 59332392) has the molecular formula C20H18N6O2S and a molecular weight of 406.47 g/mol. Its IUPAC name is 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide
PubChem CID59332392
Molecular FormulaC20H18N6O2S
Molecular Weight406.47 g/mol
Exact Mass406.12
IUPAC Name2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cnccc1N1CCOCC1)c1csc(-n2ncc3ccccc32)n1
InChIInChI=1S/C20H18N6O2S/c27-19(23-15-12-21-6-5-18(15)25-7-9-28-10-8-25)16-13-29-20(24-16)26-17-4-2-1-3-14(17)11-22-26/h1-6,11-13H,7-10H2,(H,23,27)
InChIKeyYBTPWOCMWKWAMW-UHFFFAOYSA-N
XLogP2.97
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.47
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-(1h-Indazol-1-Yl)-N-[2-(Piperazin-1-Yl)phenyl]-1,3-Thiazole-4-Carboxamide
CID 59332218
4-(4-thieno[2,3-d]pyrimidinylamino)-N-(4-((4-morpholinyl)methyl)phenyl)-1H-3-pyrazolecarboxamide
CID 72194526
2-(1H-indazol-3-ylamino)-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 24968460
6-Morpholin-4-yl-2-phenyl-pyrimidine-4-carboxylic acid (2-thiazolo[5,4-b]pyridin-2-yl-phenyl)-amide
CID 58101566
2-(3-Phenylpyrazolo[5,4-c]pyridin-1-yl)-1,3-thiazole-4-carboxylic acid
CID 59179967
2-(1,3-dihydroisoindol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 59332168
2-indazol-1-yl-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 59332249
2-acetamido-N-[3-[1-(methoxymethyl)indazol-5-yl]phenyl]-1,3-thiazole-4-carboxamide
CID 44525325
N-(2-phenyl-2H-pyrazolo[3,4-c]quinolin-4-yl)thiazole-4-carboxamide
CID 44570108
N-(2-methoxyethyl)-N-(6-methyl-4,5-dihydropyrazolo[4,5-e][1,3]benzothiazol-2-yl)pyridine-2-carboxamide
CID 46959902
4-[(5-methylthieno[2,3-d]pyrimidin-4-yl)amino]-N-[4-(morpholin-4-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide
CID 72195456
2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[4-methyl-5-[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]-1,3-thiazol-2-yl]acetamide
CID 162662660

Frequently Asked Questions

What is the IUPAC name of 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide (CID 59332392) is 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide is O=C(Nc1cnccc1N1CCOCC1)c1csc(-n2ncc3ccccc32)n1.
What is the InChIKey of 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide?
The InChIKey is YBTPWOCMWKWAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6O2S/c27-19(23-15-12-21-6-5-18(15)25-7-9-28-10-8-25)16-13-29-20(24-16)26-17-4-2-1-3-14(17)11-22-26/h1-6,11-13H,7-10H2,(H,23,27).
What are the key properties of 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide?
2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide has a molecular weight of 406.47 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indazol-1-yl-N-(4-morpholin-4-yl-3-pyridinyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 59332392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).