N-(2,4,5-trimethylpyrazol-3-yl)acetamide

C8H13N3O — CID 127292748

IUPACN-(2,4,5-trimethylpyrazol-3-yl)acetamide
SMILESCC(=O)Nc1c(C)c(C)nn1C
InChIInChI=1S/C8H13N3O/c1-5-6(2)10-11(4)8(5)9-7(3)12/h1-4H3,(H,9,12)
InChIKeyCHZCBHZICSMGFX-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.00
Rot. Bonds1

About N-(2,4,5-trimethylpyrazol-3-yl)acetamide

N-(2,4,5-trimethylpyrazol-3-yl)acetamide (PubChem CID 127292748) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is N-(2,4,5-trimethylpyrazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2,4,5-trimethylpyrazol-3-yl)acetamide
PubChem CID127292748
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC NameN-(2,4,5-trimethylpyrazol-3-yl)acetamide
SMILESCC(=O)Nc1c(C)c(C)nn1C
InChIInChI=1S/C8H13N3O/c1-5-6(2)10-11(4)8(5)9-7(3)12/h1-4H3,(H,9,12)
InChIKeyCHZCBHZICSMGFX-UHFFFAOYSA-N
XLogP1.00
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,3-dimethyl-4-phenylpyrazol-5-yl)acetamide
CID 132538742
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(2,4,5-trimethylpyrazol-3-yl)acetamide
CID 56782550
4-(2-methylimidazol-1-yl)-N-(2,4,5-trimethylpyrazol-3-yl)butanamide
CID 56782546
N-[4-(2-cyclohexylethynyl)-1,3-dimethylpyrazol-5-yl]acetamide
CID 118797994
2-[1-(difluoromethyl)-3,5-dimethylpyrazol-4-yl]-N-(2,4,5-trimethylpyrazol-3-yl)acetamide
CID 146086741
(2R)-2-methyl-4-phenoxy-N-(2,4,5-trimethylpyrazol-3-yl)butanamide
CID 95905213
2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-(2,4,5-trimethylpyrazol-3-yl)acetamide
CID 71873510
2-(2-chloro-6-methoxyphenyl)-N-(2,4,5-trimethylpyrazol-3-yl)acetamide
CID 75507798
N-(5-bromo-1,4-dimethylpyrazol-3-yl)acetamide
CID 178084428
(4-bromo-1,3-dimethylpyrazol-5-yl)urea
CID 130890934
5-chloro-1,3,4-trimethylpyrazole;ethane
CID 143473362
N-(4-iodo-1-methyl-3-phenylpyrazol-5-yl)acetamide
CID 86717324

Frequently Asked Questions

What is the IUPAC name of N-(2,4,5-trimethylpyrazol-3-yl)acetamide?
The IUPAC name of N-(2,4,5-trimethylpyrazol-3-yl)acetamide (CID 127292748) is N-(2,4,5-trimethylpyrazol-3-yl)acetamide.
What is the SMILES notation for N-(2,4,5-trimethylpyrazol-3-yl)acetamide?
The canonical SMILES for N-(2,4,5-trimethylpyrazol-3-yl)acetamide is CC(=O)Nc1c(C)c(C)nn1C.
What is the InChIKey of N-(2,4,5-trimethylpyrazol-3-yl)acetamide?
The InChIKey is CHZCBHZICSMGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5-6(2)10-11(4)8(5)9-7(3)12/h1-4H3,(H,9,12).
What are the key properties of N-(2,4,5-trimethylpyrazol-3-yl)acetamide?
N-(2,4,5-trimethylpyrazol-3-yl)acetamide has a molecular weight of 167.21 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4,5-trimethylpyrazol-3-yl)acetamide is sourced from PubChem (CID 127292748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).