N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide

C14H15F3N4O2 — CID 154782137

IUPACN-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide
SMILESCn1ccc(-c2cc(C(=O)N(CC(F)(F)F)C3CCC3)no2)n1
InChIInChI=1S/C14H15F3N4O2/c1-20-6-5-10(18-20)12-7-11(19-23-12)13(22)21(8-14(15,16)17)9-3-2-4-9/h5-7,9H,2-4,8H2,1H3
InChIKeyGFKIGYZTIKSVED-UHFFFAOYSA-N
MW328.29 g/mol
LogP2.63
Rot. Bonds4

About N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide

N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide (PubChem CID 154782137) has the molecular formula C14H15F3N4O2 and a molecular weight of 328.29 g/mol. Its IUPAC name is N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide
PubChem CID154782137
Molecular FormulaC14H15F3N4O2
Molecular Weight328.29 g/mol
Exact Mass328.11
IUPAC NameN-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide
SMILESCn1ccc(-c2cc(C(=O)N(CC(F)(F)F)C3CCC3)no2)n1
InChIInChI=1S/C14H15F3N4O2/c1-20-6-5-10(18-20)12-7-11(19-23-12)13(22)21(8-14(15,16)17)9-3-2-4-9/h5-7,9H,2-4,8H2,1H3
InChIKeyGFKIGYZTIKSVED-UHFFFAOYSA-N
XLogP2.63
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.29
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide (CID 154782137) is N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide is Cn1ccc(-c2cc(C(=O)N(CC(F)(F)F)C3CCC3)no2)n1.
What is the InChIKey of N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is GFKIGYZTIKSVED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F3N4O2/c1-20-6-5-10(18-20)12-7-11(19-23-12)13(22)21(8-14(15,16)17)9-3-2-4-9/h5-7,9H,2-4,8H2,1H3.
What are the key properties of N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide?
N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 328.29 g/mol, XLogP of 2.63, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-5-(1-methylpyrazol-3-yl)-N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 154782137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).