N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide

C17H13N5O — CID 28955856

IUPACN-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(-n2cccn2)cc1)c1n[nH]c2ccccc12
InChIInChI=1S/C17H13N5O/c23-17(16-14-4-1-2-5-15(14)20-21-16)19-12-6-8-13(9-7-12)22-11-3-10-18-22/h1-11H,(H,19,23)(H,20,21)
InChIKeyXKIGAZHLNSKEAI-UHFFFAOYSA-N
MW303.33 g/mol
LogP3.00
Rot. Bonds3

About N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide

N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide (PubChem CID 28955856) has the molecular formula C17H13N5O and a molecular weight of 303.33 g/mol. Its IUPAC name is N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide
PubChem CID28955856
Molecular FormulaC17H13N5O
Molecular Weight303.33 g/mol
Exact Mass303.11
IUPAC NameN-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(-n2cccn2)cc1)c1n[nH]c2ccccc12
InChIInChI=1S/C17H13N5O/c23-17(16-14-4-1-2-5-15(14)20-21-16)19-12-6-8-13(9-7-12)22-11-3-10-18-22/h1-11H,(H,19,23)(H,20,21)
InChIKeyXKIGAZHLNSKEAI-UHFFFAOYSA-N
XLogP3.00
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-propan-2-ylphenyl)-1H-indazole-3-carboxamide
CID 42477807
N-[4-(4-carbamoylpiperidin-1-yl)phenyl]-1H-indazole-3-carboxamide
CID 51129949
N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
CID 35275358
N-(6-imidazol-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 35438277
4-pyrazol-1-yl-N-pyridin-4-ylbenzamide
CID 27700232
N-(3-acetamidophenyl)-1H-indazole-3-carboxamide
CID 9114494
N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 154796255
N-quinolin-7-yl-1H-indazole-3-carboxamide
CID 28734040
N-(4-bromo-3-methylphenyl)-1H-indazole-3-carboxamide
CID 9069923
N-(1-propylindol-5-yl)-1H-indazole-3-carboxamide
CID 60607032
2-[4-(1H-indazole-3-carbonylamino)pyrazol-1-yl]acetic acid
CID 61018614
N-[(4-acetamidophenyl)methyl]-1H-indazole-3-carboxamide
CID 18154228

Frequently Asked Questions

What is the IUPAC name of N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide (CID 28955856) is N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide is O=C(Nc1ccc(-n2cccn2)cc1)c1n[nH]c2ccccc12.
What is the InChIKey of N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide?
The InChIKey is XKIGAZHLNSKEAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5O/c23-17(16-14-4-1-2-5-15(14)20-21-16)19-12-6-8-13(9-7-12)22-11-3-10-18-22/h1-11H,(H,19,23)(H,20,21).
What are the key properties of N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide?
N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide has a molecular weight of 303.33 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrazol-1-ylphenyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 28955856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).