6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide

C18H14N8OS — CID 71267284

IUPAC6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide
SMILESO=C(Nc1cnn(Cc2cscn2)c1)c1n[nH]c2cc(-c3ccn[nH]3)ccc12
InChIInChI=1S/C18H14N8OS/c27-18(22-12-6-21-26(7-12)8-13-9-28-10-19-13)17-14-2-1-11(5-16(14)24-25-17)15-3-4-20-23-15/h1-7,9-10H,8H2,(H,20,23)(H,22,27)(H,24,25)
InChIKeyKYSSKAYAVCJENL-UHFFFAOYSA-N
MW390.43 g/mol
LogP2.91
Rot. Bonds5

About 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide

6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide (PubChem CID 71267284) has the molecular formula C18H14N8OS and a molecular weight of 390.43 g/mol. Its IUPAC name is 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide
PubChem CID71267284
Molecular FormulaC18H14N8OS
Molecular Weight390.43 g/mol
Exact Mass390.10
IUPAC Name6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide
SMILESO=C(Nc1cnn(Cc2cscn2)c1)c1n[nH]c2cc(-c3ccn[nH]3)ccc12
InChIInChI=1S/C18H14N8OS/c27-18(22-12-6-21-26(7-12)8-13-9-28-10-19-13)17-14-2-1-11(5-16(14)24-25-17)15-3-4-20-23-15/h1-7,9-10H,8H2,(H,20,23)(H,22,27)(H,24,25)
InChIKeyKYSSKAYAVCJENL-UHFFFAOYSA-N
XLogP2.91
TPSA117.17 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.43
LogP ≤ 52.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

N-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
CID 71267356
N-(1-benzylpyrazol-4-yl)-6-[2-(methylamino)-1,3-thiazol-5-yl]-1H-indazole-3-carboxamide
CID 89412129
N-[1-[(3-cyano-5-methylphenyl)methyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
CID 123936431
N-[1-[(3-aminophenyl)methyl]pyrazol-4-yl]-5-methyl-6-(1H-pyrazol-5-yl)-1H-indazole-3-carboxamide
CID 89412133
6-(1H-pyrazol-4-yl)-N-[1-[[3-(2H-tetrazol-5-yl)phenyl]methyl]pyrazol-4-yl]-1H-indazole-3-carboxamide
CID 71267328
6-(6-amino-3-pyridinyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-1H-indazole-3-carboxamide
CID 71259500
N-[1-[(2Z,4Z)-2,5-diaminopenta-2,4-dienyl]pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
CID 144529909
N-(1-propan-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
CID 71267344
N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
CID 71267375
2-[4-(1H-indazole-3-carbonylamino)pyrazol-1-yl]acetic acid
CID 61018614
5-amino-N-(1-ethylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 60905133
N-[1-[(2,4-difluorophenyl)methyl]pyrazol-4-yl]-1H-indazole-3-carboxamide
CID 71259778

Frequently Asked Questions

What is the IUPAC name of 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide?
The IUPAC name of 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide (CID 71267284) is 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide.
What is the SMILES notation for 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide?
The canonical SMILES for 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide is O=C(Nc1cnn(Cc2cscn2)c1)c1n[nH]c2cc(-c3ccn[nH]3)ccc12.
What is the InChIKey of 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide?
The InChIKey is KYSSKAYAVCJENL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N8OS/c27-18(22-12-6-21-26(7-12)8-13-9-28-10-19-13)17-14-2-1-11(5-16(14)24-25-17)15-3-4-20-23-15/h1-7,9-10H,8H2,(H,20,23)(H,22,27)(H,24,25).
What are the key properties of 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide?
6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide has a molecular weight of 390.43 g/mol, XLogP of 2.91, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-pyrazol-5-yl)-N-[1-(1,3-thiazol-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 71267284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).