N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide

C14H17F3N4O2 — CID 146131636

IUPACN-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
SMILESCC(C)(C)c1cnc(CNC(=O)Cn2ccc(C(F)(F)F)n2)o1
InChIInChI=1S/C14H17F3N4O2/c1-13(2,3)10-6-19-12(23-10)7-18-11(22)8-21-5-4-9(20-21)14(15,16)17/h4-6H,7-8H2,1-3H3,(H,18,22)
InChIKeyHPUFBMDUTGNDDU-UHFFFAOYSA-N
MW330.31 g/mol
LogP2.50
Rot. Bonds4

About N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide

N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide (PubChem CID 146131636) has the molecular formula C14H17F3N4O2 and a molecular weight of 330.31 g/mol. Its IUPAC name is N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
PubChem CID146131636
Molecular FormulaC14H17F3N4O2
Molecular Weight330.31 g/mol
Exact Mass330.13
IUPAC NameN-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
SMILESCC(C)(C)c1cnc(CNC(=O)Cn2ccc(C(F)(F)F)n2)o1
InChIInChI=1S/C14H17F3N4O2/c1-13(2,3)10-6-19-12(23-10)7-18-11(22)8-21-5-4-9(20-21)14(15,16)17/h4-6H,7-8H2,1-3H3,(H,18,22)
InChIKeyHPUFBMDUTGNDDU-UHFFFAOYSA-N
XLogP2.50
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.31
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-tert-butyl-2-[(1S)-1-[3-(trifluoromethyl)pyrazol-1-yl]ethyl]-1,3-oxazole
CID 97056204
4-methyl-2-N-[3-methyl-1-[2-(5-methyl-1,3-oxazol-2-yl)propan-2-yl]pyrazol-4-yl]-5-(trifluoromethyl)-1H-pyrimidine-2,4-diamine
CID 152406681
5-Tert-butyl-2-[1-[3-(trifluoromethyl)pyrazol-1-yl]ethyl]-1,3-oxazole
CID 71971722
1-[3,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 75521370
N-[1-(5-Tert-butyl-1,3-oxazol-2-YL)ethyl]-1-(2,2-difluoroethyl)pyrazol-4-amine
CID 86791913
N-[1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)pyrazol-4-amine
CID 86817475
5-tert-butyl-2-[(1R)-1-[3-(trifluoromethyl)pyrazol-1-yl]ethyl]-1,3-oxazole
CID 97056205
(1S)-1-[3,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 97824653
(1R)-1-[3,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 97824655
N-[(1S)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)pyrazol-4-amine
CID 99614495
N-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)pyrazol-4-amine
CID 99614497
N-[(1S)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]-1-(2,2-difluoroethyl)pyrazol-4-amine
CID 99822993

Frequently Asked Questions

What is the IUPAC name of N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The IUPAC name of N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide (CID 146131636) is N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The canonical SMILES for N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide is CC(C)(C)c1cnc(CNC(=O)Cn2ccc(C(F)(F)F)n2)o1.
What is the InChIKey of N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The InChIKey is HPUFBMDUTGNDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N4O2/c1-13(2,3)10-6-19-12(23-10)7-18-11(22)8-21-5-4-9(20-21)14(15,16)17/h4-6H,7-8H2,1-3H3,(H,18,22).
What are the key properties of N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide?
N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide has a molecular weight of 330.31 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide is sourced from PubChem (CID 146131636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).