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N-(2,5-dimethylpyrazol-3-yl)acetamide

HCID 574162
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
75092-37-4
Standard SMILES
CC(=O)Nc1cc(C)nn1C
InChIKey
SOEINDPDOWSEPB-UHFFFAOYSA-N
Molecular formula
C7H11N3O
Average molar mass
153.18 g/mol
Monoisotopic mass
153.09021198

Names & identifiers

Preferred name
N-(2,5-dimethylpyrazol-3-yl)acetamide
IUPAC
N-(2,5-dimethylpyrazol-3-yl)acetamide
English name
Acetamide, N-(1,3-dimethyl-1H-pyrazol-5-yl)-
Molecular formula
C7H11N3O
Molecular weight
153.18

Names & synonyms

N-(2,5-dimethylpyrazol-3-yl)acetamide75092-37-4N-(1,3-Dimethyl-1H-pyrazol-5-yl)acetamideAcetamide, N-(1,3-dimethyl-1H-pyrazol-5-yl)-MFCD01566426Maybridge3_003503SCHEMBL48934SOEINDPDOWSEPB-UHFFFAOYSA-DTXSID60341587HMS1440P055-acetylamino-1,3-dimethylpyrazoleCCG-54105
Show more names
IDI1_014890BS-24343DB-308432CS-0204928N-(2,5-dimethyl-2H-pyrazol-3-yl)-acetamideAcetamide, N-(1,3-dimethyl-1H-5-pyrazolyl)-N-(1,3-Dimethyl-1H-pyrazol-5-yl)acetamide #SR-01000643226-1

Database identifiers

CAS
75092-37-4
PubChem CID
574162
DTXSID
DTXSID60341587

Properties

Computed structural properties

XLogP
0.1
Topological polar surface area
46.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
160

Physicochemical properties

Melting point
57 · 57-58 °C
Boiling point
338.6 · 338.6±22.0 °C(Predicted)
Density
1.16 · 1.16±0.1 g/cm3(Predicted)
pka
14.57 · 14.57±0.70(Predicted)
HS Code
2933199090 · 2933199090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2933199090

Chemistry & industry

Upstream & downstream products

Downstream products

6-CHLORO-1,3-DIMETHYL-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBALDEHYDE

Suppliers5 total

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
成都效佳科技有限公司15902830537 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]

Related reactions

5 records
New reaction record
HRID 198946 reaction equation
HRID 198946As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 577765 reaction equation
HRID 577765As productuspto-grants-2015_05
HRID 1045973 reaction equation
HRID 1045973As productuspto-grants-2013_10
HRID 1045974 reaction equation
HRID 1045974As reactantuspto-grants-2013_10
HRID 1911730 reaction equation
HRID 1911730As productuspto-grants-2013_12

Compound notes

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