N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide

C22H20N4OS — CID 55948097

IUPACN-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide
SMILESO=C(Cc1csc(Cc2ccccc2)n1)Nc1cnn(Cc2ccccc2)c1
InChIInChI=1S/C22H20N4OS/c27-21(12-19-16-28-22(25-19)11-17-7-3-1-4-8-17)24-20-13-23-26(15-20)14-18-9-5-2-6-10-18/h1-10,13,15-16H,11-12,14H2,(H,24,27)
InChIKeyDZXSCWIARIPCRI-UHFFFAOYSA-N
MW388.50 g/mol
LogP4.16
Rot. Bonds7

About N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide

N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide (PubChem CID 55948097) has the molecular formula C22H20N4OS and a molecular weight of 388.50 g/mol. Its IUPAC name is N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide
PubChem CID55948097
Molecular FormulaC22H20N4OS
Molecular Weight388.50 g/mol
Exact Mass388.14
IUPAC NameN-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide
SMILESO=C(Cc1csc(Cc2ccccc2)n1)Nc1cnn(Cc2ccccc2)c1
InChIInChI=1S/C22H20N4OS/c27-21(12-19-16-28-22(25-19)11-17-7-3-1-4-8-17)24-20-13-23-26(15-20)14-18-9-5-2-6-10-18/h1-10,13,15-16H,11-12,14H2,(H,24,27)
InChIKeyDZXSCWIARIPCRI-UHFFFAOYSA-N
XLogP4.16
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.50
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[[2-(2-benzyl-1,3-thiazol-4-yl)acetyl]amino]phenyl]-2-pyrazol-1-ylpropanamide
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2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide
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N-(2-aminoethyl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide
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2-(2-benzyl-1,3-thiazol-4-yl)-N-[2-(1-phenylpyrazol-4-yl)ethyl]acetamide
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CID 95769499
N-(1-benzylpyrazol-4-yl)-2-(4-chloropyrazol-1-yl)acetamide
CID 19397538
N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-phenylacetamide
CID 19346309
2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide (CID 55948097) is N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide is O=C(Cc1csc(Cc2ccccc2)n1)Nc1cnn(Cc2ccccc2)c1.
What is the InChIKey of N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is DZXSCWIARIPCRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4OS/c27-21(12-19-16-28-22(25-19)11-17-7-3-1-4-8-17)24-20-13-23-26(15-20)14-18-9-5-2-6-10-18/h1-10,13,15-16H,11-12,14H2,(H,24,27).
What are the key properties of N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide?
N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 388.50 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 55948097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).