N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide

C7H11N3O — CID 854297

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
SMILESCC(=O)Nc1c(C)n[nH]c1C
InChIInChI=1S/C7H11N3O/c1-4-7(8-6(3)11)5(2)10-9-4/h1-3H3,(H,8,11)(H,9,10)
InChIKeyILCJEJQTTQLILC-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.98
Rot. Bonds1

About N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide

N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide (PubChem CID 854297) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
PubChem CID854297
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
SMILESCC(=O)Nc1c(C)n[nH]c1C
InChIInChI=1S/C7H11N3O/c1-4-7(8-6(3)11)5(2)10-9-4/h1-3H3,(H,8,11)(H,9,10)
InChIKeyILCJEJQTTQLILC-UHFFFAOYSA-N
XLogP0.98
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-Dimethyl-1H-pyrazol-4-yl)butanamide
CID 740336
N-(1-acetyl-3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 676642
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(methylamino)acetamide
CID 2452215
N-[3,5-dimethyl-1-(1-oxopropyl)-4-pyrazolyl]propanamide
CID 573814
N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
CID 745362
N-(1-butanoyl-3,5-dimethylpyrazol-4-yl)butanamide
CID 745532
2-chloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 806433
3-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide dihydrochloride
CID 54592690
4-((3,5-dimethyl-1H-pyrazol-4-yl)amino)-4-oxobutanoic acid
CID 16645428
N-(3,5-diethyl-1H-pyrazol-4-yl)-2-methylpropanamide
CID 42686716
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-methylbutanamide
CID 43399085
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[ethyl(2-ethylbutyl)amino]acetamide
CID 40166965

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide (CID 854297) is N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide is CC(=O)Nc1c(C)n[nH]c1C.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide?
The InChIKey is ILCJEJQTTQLILC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-4-7(8-6(3)11)5(2)10-9-4/h1-3H3,(H,8,11)(H,9,10).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide has a molecular weight of 153.18 g/mol, XLogP of 0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 854297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).