N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide

C19H23N5OS — CID 46994696

IUPACN-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide
SMILESCc1cn(CC(=O)Nc2ccnn2C2CCCCC2)nc1-c1cccs1
InChIInChI=1S/C19H23N5OS/c1-14-12-23(22-19(14)16-8-5-11-26-16)13-18(25)21-17-9-10-20-24(17)15-6-3-2-4-7-15/h5,8-12,15H,2-4,6-7,13H2,1H3,(H,21,25)
InChIKeyFMEXTXPRWDQSCQ-UHFFFAOYSA-N
MW369.49 g/mol
LogP4.26
Rot. Bonds5

About N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide

N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide (PubChem CID 46994696) has the molecular formula C19H23N5OS and a molecular weight of 369.49 g/mol. Its IUPAC name is N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide
PubChem CID46994696
Molecular FormulaC19H23N5OS
Molecular Weight369.49 g/mol
Exact Mass369.16
IUPAC NameN-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide
SMILESCc1cn(CC(=O)Nc2ccnn2C2CCCCC2)nc1-c1cccs1
InChIInChI=1S/C19H23N5OS/c1-14-12-23(22-19(14)16-8-5-11-26-16)13-18(25)21-17-9-10-20-24(17)15-6-3-2-4-7-15/h5,8-12,15H,2-4,6-7,13H2,1H3,(H,21,25)
InChIKeyFMEXTXPRWDQSCQ-UHFFFAOYSA-N
XLogP4.26
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.49
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide?
The IUPAC name of N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide (CID 46994696) is N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide.
What is the SMILES notation for N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide?
The canonical SMILES for N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide is Cc1cn(CC(=O)Nc2ccnn2C2CCCCC2)nc1-c1cccs1.
What is the InChIKey of N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide?
The InChIKey is FMEXTXPRWDQSCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5OS/c1-14-12-23(22-19(14)16-8-5-11-26-16)13-18(25)21-17-9-10-20-24(17)15-6-3-2-4-7-15/h5,8-12,15H,2-4,6-7,13H2,1H3,(H,21,25).
What are the key properties of N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide?
N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide has a molecular weight of 369.49 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide is sourced from PubChem (CID 46994696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).