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

C10H14F3N3O2 — CID 62334429

IUPACN-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
SMILESCC(O)CN(C)C(=O)Cn1ccc(C(F)(F)F)n1
InChIInChI=1S/C10H14F3N3O2/c1-7(17)5-15(2)9(18)6-16-4-3-8(14-16)10(11,12)13/h3-4,7,17H,5-6H2,1-2H3
InChIKeyZTLSCHMHGXZVDY-UHFFFAOYSA-N
MW265.23 g/mol
LogP0.74
Rot. Bonds4

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

N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide (PubChem CID 62334429) has the molecular formula C10H14F3N3O2 and a molecular weight of 265.23 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
PubChem CID62334429
Molecular FormulaC10H14F3N3O2
Molecular Weight265.23 g/mol
Exact Mass265.10
IUPAC NameN-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
SMILESCC(O)CN(C)C(=O)Cn1ccc(C(F)(F)F)n1
InChIInChI=1S/C10H14F3N3O2/c1-7(17)5-15(2)9(18)6-16-4-3-8(14-16)10(11,12)13/h3-4,7,17H,5-6H2,1-2H3
InChIKeyZTLSCHMHGXZVDY-UHFFFAOYSA-N
XLogP0.74
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.23
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The IUPAC name of N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide (CID 62334429) is N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The canonical SMILES for N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide is CC(O)CN(C)C(=O)Cn1ccc(C(F)(F)F)n1.
What is the InChIKey of N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The InChIKey is ZTLSCHMHGXZVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3O2/c1-7(17)5-15(2)9(18)6-16-4-3-8(14-16)10(11,12)13/h3-4,7,17H,5-6H2,1-2H3.
What are the key properties of N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide has a molecular weight of 265.23 g/mol, XLogP of 0.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-N-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide is sourced from PubChem (CID 62334429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).