N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide

C10H12F3N3O — CID 115593407

IUPACN-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
SMILESCN(C(=O)Cn1ccc(C(F)(F)F)n1)C1CC1
InChIInChI=1S/C10H12F3N3O/c1-15(7-2-3-7)9(17)6-16-5-4-8(14-16)10(11,12)13/h4-5,7H,2-3,6H2,1H3
InChIKeyNMZOZLCSOVUKRI-UHFFFAOYSA-N
MW247.22 g/mol
LogP1.52
Rot. Bonds3

About N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide

N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide (PubChem CID 115593407) has the molecular formula C10H12F3N3O and a molecular weight of 247.22 g/mol. Its IUPAC name is N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
PubChem CID115593407
Molecular FormulaC10H12F3N3O
Molecular Weight247.22 g/mol
Exact Mass247.09
IUPAC NameN-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
SMILESCN(C(=O)Cn1ccc(C(F)(F)F)n1)C1CC1
InChIInChI=1S/C10H12F3N3O/c1-15(7-2-3-7)9(17)6-16-5-4-8(14-16)10(11,12)13/h4-5,7H,2-3,6H2,1H3
InChIKeyNMZOZLCSOVUKRI-UHFFFAOYSA-N
XLogP1.52
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2-methylpropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 79291704
2-[cyclopropylmethyl-[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]acetic acid
CID 43655345
N-cyclopropyl-N-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 52573052
N-cyclopropyl-N-[(1S)-1-[3-(trifluoromethyl)phenyl]ethyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 52573051
2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 2809216
1-(4-hydroxypiperidin-1-yl)-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanone
CID 43393908
N-cyclopropyl-4-[[cyclopropyl-[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]methyl]benzamide
CID 34179141
N-[(2,3-dichlorophenyl)methyl]-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 55328818
N-benzyl-N-[(2S)-2-hydroxypropyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 95778125
N-(1-cyclopropylethyl)-N-[(4-methoxyphenyl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 71684734
N-(1,3-benzothiazol-2-yl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 34253736
propan-2-yl 2-[3-(trifluoromethyl)pyrazol-1-yl]acetate
CID 60643569

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide (CID 115593407) is N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide is CN(C(=O)Cn1ccc(C(F)(F)F)n1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The InChIKey is NMZOZLCSOVUKRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3O/c1-15(7-2-3-7)9(17)6-16-5-4-8(14-16)10(11,12)13/h4-5,7H,2-3,6H2,1H3.
What are the key properties of N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide has a molecular weight of 247.22 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide is sourced from PubChem (CID 115593407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).