(2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide

C10H16F3NO3 — CID 51943621

IUPAC(2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide
SMILESC[C@@H](OCC(F)(F)F)C(=O)NC[C@@H]1CCCO1
InChIInChI=1S/C10H16F3NO3/c1-7(17-6-10(11,12)13)9(15)14-5-8-3-2-4-16-8/h7-8H,2-6H2,1H3,(H,14,15)/t7-,8+/m1/s1
InChIKeyPUPSPSHKHRWBNZ-SFYZADRCSA-N
MW255.24 g/mol
LogP1.25
Rot. Bonds5

About (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide

(2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide (PubChem CID 51943621) has the molecular formula C10H16F3NO3 and a molecular weight of 255.24 g/mol. Its IUPAC name is (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide
PubChem CID51943621
Molecular FormulaC10H16F3NO3
Molecular Weight255.24 g/mol
Exact Mass255.11
IUPAC Name(2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide
SMILESC[C@@H](OCC(F)(F)F)C(=O)NC[C@@H]1CCCO1
InChIInChI=1S/C10H16F3NO3/c1-7(17-6-10(11,12)13)9(15)14-5-8-3-2-4-16-8/h7-8H,2-6H2,1H3,(H,14,15)/t7-,8+/m1/s1
InChIKeyPUPSPSHKHRWBNZ-SFYZADRCSA-N
XLogP1.25
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.24
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(Methylamino)propyl]oxolane-2-carboxamide
CID 10535559
Acetamide, N-tetrahydrofurfuryl-2,2,2-trifluoro-
CID 532126
N-(2-methylpropyl)oxolane-2-carboxamide
CID 3307864
Pentanamide, N-tetrahydrofurfuryl-
CID 531771
Butanamide, N-tetrahydrofurfuryl-
CID 531792
Propanamide, N-tetrahydrofurfuryl-2,2-dimethyl-
CID 532034
Acetamide, N-tetrahydrofurfuryl-2-methoxy-
CID 532079
Propanamide, N-tetrahydrofurfuryl-2-methyl-
CID 532133
(2S)-N-(4,4-difluorocyclohexyl)oxolane-2-carboxamide
CID 127690902
2,2,3,3,4,4,4-heptafluoro-N-(oxolan-2-ylmethyl)butanamide
CID 5237136
N-(4,4-difluorocyclohexyl)oxolane-2-carboxamide
CID 90773517
2,2,2-trifluoro-N-[2-[5-(methylamino)pentoxy]ethyl]acetamide
CID 118151604

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The IUPAC name of (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide (CID 51943621) is (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide.
What is the SMILES notation for (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The canonical SMILES for (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide is C[C@@H](OCC(F)(F)F)C(=O)NC[C@@H]1CCCO1.
What is the InChIKey of (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The InChIKey is PUPSPSHKHRWBNZ-SFYZADRCSA-N. The full InChI is InChI=1S/C10H16F3NO3/c1-7(17-6-10(11,12)13)9(15)14-5-8-3-2-4-16-8/h7-8H,2-6H2,1H3,(H,14,15)/t7-,8+/m1/s1.
What are the key properties of (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide?
(2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide has a molecular weight of 255.24 g/mol, XLogP of 1.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(2,2,2-trifluoroethoxy)propanamide is sourced from PubChem (CID 51943621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).