N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide

C12H13F3N2O4 — CID 166278450

IUPACN-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide
SMILESO=C(Cc1cc(C(F)(F)F)co1)NCC(=O)N1CCCO1
InChIInChI=1S/C12H13F3N2O4/c13-12(14,15)8-4-9(20-7-8)5-10(18)16-6-11(19)17-2-1-3-21-17/h4,7H,1-3,5-6H2,(H,16,18)
InChIKeyYTPVPFGPRKHPRG-UHFFFAOYSA-N
MW306.24 g/mol
LogP1.12
Rot. Bonds4

About N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide

N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide (PubChem CID 166278450) has the molecular formula C12H13F3N2O4 and a molecular weight of 306.24 g/mol. Its IUPAC name is N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide.

Molecular Properties

Compound NameN-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide
PubChem CID166278450
Molecular FormulaC12H13F3N2O4
Molecular Weight306.24 g/mol
Exact Mass306.08
IUPAC NameN-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide
SMILESO=C(Cc1cc(C(F)(F)F)co1)NCC(=O)N1CCCO1
InChIInChI=1S/C12H13F3N2O4/c13-12(14,15)8-4-9(20-7-8)5-10(18)16-6-11(19)17-2-1-3-21-17/h4,7H,1-3,5-6H2,(H,16,18)
InChIKeyYTPVPFGPRKHPRG-UHFFFAOYSA-N
XLogP1.12
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.24
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide?
The IUPAC name of N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide (CID 166278450) is N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide.
What is the SMILES notation for N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide?
The canonical SMILES for N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide is O=C(Cc1cc(C(F)(F)F)co1)NCC(=O)N1CCCO1.
What is the InChIKey of N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide?
The InChIKey is YTPVPFGPRKHPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F3N2O4/c13-12(14,15)8-4-9(20-7-8)5-10(18)16-6-11(19)17-2-1-3-21-17/h4,7H,1-3,5-6H2,(H,16,18).
What are the key properties of N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide?
N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide has a molecular weight of 306.24 g/mol, XLogP of 1.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,2-oxazolidin-2-yl)-2-oxoethyl]-2-[4-(trifluoromethyl)furan-2-yl]acetamide is sourced from PubChem (CID 166278450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).