2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide

C10H15F3N4O — CID 62112397

IUPAC2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(F)(F)F)C(=O)Cn1ccc(N)n1
InChIInChI=1S/C10H15F3N4O/c1-7(2)17(6-10(11,12)13)9(18)5-16-4-3-8(14)15-16/h3-4,7H,5-6H2,1-2H3,(H2,14,15)
InChIKeyCWZOIVJTZFQADN-UHFFFAOYSA-N
MW264.25 g/mol
LogP1.26
Rot. Bonds4

About 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide

2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 62112397) has the molecular formula C10H15F3N4O and a molecular weight of 264.25 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID62112397
Molecular FormulaC10H15F3N4O
Molecular Weight264.25 g/mol
Exact Mass264.12
IUPAC Name2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(F)(F)F)C(=O)Cn1ccc(N)n1
InChIInChI=1S/C10H15F3N4O/c1-7(2)17(6-10(11,12)13)9(18)5-16-4-3-8(14)15-16/h3-4,7H,5-6H2,1-2H3,(H2,14,15)
InChIKeyCWZOIVJTZFQADN-UHFFFAOYSA-N
XLogP1.26
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 62112397) is 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide is CC(C)N(CC(F)(F)F)C(=O)Cn1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is CWZOIVJTZFQADN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N4O/c1-7(2)17(6-10(11,12)13)9(18)5-16-4-3-8(14)15-16/h3-4,7H,5-6H2,1-2H3,(H2,14,15).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 264.25 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 62112397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).