N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide

C20H19N5O — CID 59735133

IUPACN-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
SMILESCCCc1c(C(=O)Nc2ccc3cn[nH]c3c2)cnn1-c1ccccc1
InChIInChI=1S/C20H19N5O/c1-2-6-19-17(13-22-25(19)16-7-4-3-5-8-16)20(26)23-15-10-9-14-12-21-24-18(14)11-15/h3-5,7-13H,2,6H2,1H3,(H,21,24)(H,23,26)
InChIKeyLZYJQOXGYZZYRS-UHFFFAOYSA-N
MW345.41 g/mol
LogP3.95
Rot. Bonds5

About N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide

N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide (PubChem CID 59735133) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
PubChem CID59735133
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC NameN-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
SMILESCCCc1c(C(=O)Nc2ccc3cn[nH]c3c2)cnn1-c1ccccc1
InChIInChI=1S/C20H19N5O/c1-2-6-19-17(13-22-25(19)16-7-4-3-5-8-16)20(26)23-15-10-9-14-12-21-24-18(14)11-15/h3-5,7-13H,2,6H2,1H3,(H,21,24)(H,23,26)
InChIKeyLZYJQOXGYZZYRS-UHFFFAOYSA-N
XLogP3.95
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The IUPAC name of N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide (CID 59735133) is N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide.
What is the SMILES notation for N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The canonical SMILES for N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide is CCCc1c(C(=O)Nc2ccc3cn[nH]c3c2)cnn1-c1ccccc1.
What is the InChIKey of N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The InChIKey is LZYJQOXGYZZYRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-2-6-19-17(13-22-25(19)16-7-4-3-5-8-16)20(26)23-15-10-9-14-12-21-24-18(14)11-15/h3-5,7-13H,2,6H2,1H3,(H,21,24)(H,23,26).
What are the key properties of N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide has a molecular weight of 345.41 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide is sourced from PubChem (CID 59735133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).