2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide

C15H20F3N3O4 — CID 154876580

IUPAC2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide
SMILESO=C1NC(C(=O)NCC2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CO1
InChIInChI=1S/C15H20F3N3O4/c16-15(17,18)14(3-4-14)12(23)21-5-1-9(2-6-21)7-19-11(22)10-8-25-13(24)20-10/h9-10H,1-8H2,(H,19,22)(H,20,24)
InChIKeyRSFXJFBSYHHWKA-UHFFFAOYSA-N
MW363.34 g/mol
LogP0.79
Rot. Bonds4

About 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide

2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide (PubChem CID 154876580) has the molecular formula C15H20F3N3O4 and a molecular weight of 363.34 g/mol. Its IUPAC name is 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide
PubChem CID154876580
Molecular FormulaC15H20F3N3O4
Molecular Weight363.34 g/mol
Exact Mass363.14
IUPAC Name2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide
SMILESO=C1NC(C(=O)NCC2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CO1
InChIInChI=1S/C15H20F3N3O4/c16-15(17,18)14(3-4-14)12(23)21-5-1-9(2-6-21)7-19-11(22)10-8-25-13(24)20-10/h9-10H,1-8H2,(H,19,22)(H,20,24)
InChIKeyRSFXJFBSYHHWKA-UHFFFAOYSA-N
XLogP0.79
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.34
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-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 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide?
The IUPAC name of 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide (CID 154876580) is 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide.
What is the SMILES notation for 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide?
The canonical SMILES for 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide is O=C1NC(C(=O)NCC2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CO1.
What is the InChIKey of 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide?
The InChIKey is RSFXJFBSYHHWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F3N3O4/c16-15(17,18)14(3-4-14)12(23)21-5-1-9(2-6-21)7-19-11(22)10-8-25-13(24)20-10/h9-10H,1-8H2,(H,19,22)(H,20,24).
What are the key properties of 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide?
2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide has a molecular weight of 363.34 g/mol, XLogP of 0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[[1-[1-(trifluoromethyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]-1,3-oxazolidine-4-carboxamide is sourced from PubChem (CID 154876580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).