2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide

C10H19F3N2O2 — CID 58007240

IUPAC2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide
SMILESCC(C)NCCOCCN(C)C(=O)C(F)(F)F
InChIInChI=1S/C10H19F3N2O2/c1-8(2)14-4-6-17-7-5-15(3)9(16)10(11,12)13/h8,14H,4-7H2,1-3H3
InChIKeyLCGKYHVUQDRDDB-UHFFFAOYSA-N
MW256.27 g/mol
LogP1.02
Rot. Bonds7

About 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide

2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide (PubChem CID 58007240) has the molecular formula C10H19F3N2O2 and a molecular weight of 256.27 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide
PubChem CID58007240
Molecular FormulaC10H19F3N2O2
Molecular Weight256.27 g/mol
Exact Mass256.14
IUPAC Name2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide
SMILESCC(C)NCCOCCN(C)C(=O)C(F)(F)F
InChIInChI=1S/C10H19F3N2O2/c1-8(2)14-4-6-17-7-5-15(3)9(16)10(11,12)13/h8,14H,4-7H2,1-3H3
InChIKeyLCGKYHVUQDRDDB-UHFFFAOYSA-N
XLogP1.02
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,2,2-trifluoro-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 14511495
2,2,2-trifluoro-N-[(2S)-1-methoxypropan-2-yl]acetamide
CID 14511496
N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide
CID 37981198
N-[2-[3-bis[di(propan-2-yl)amino]phosphanylpropoxy]ethyl]-2,2,2-trifluoroacetamide
CID 57704153
N-(1-ethoxypropan-2-yl)-2,2,2-trifluoroacetamide
CID 57737704
tert-butyl N-propan-2-yl-N-[2-[2-[(2,2,2-trifluoroacetyl)amino]ethoxy]ethyl]carbamate
CID 58006935
N-(2-ethoxyethyl)-2,2,2-trifluoroacetamide
CID 62492523
N-[2-(2-aminoethoxy)ethyl]-2,2,2-trifluoroacetamide
CID 82354257
Propan-2-yl-[2-[2-[(2,2,2-trifluoroacetyl)amino]ethoxy]ethyl]carbamic acid
CID 87583117
N-(2-ethoxyethyl)-2,2-difluoroacetamide
CID 89219285
2,2,2-trifluoro-N-[2-(2-propoxyethoxy)ethyl]acetamide
CID 117790512
N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]-2,2,2-trifluoroacetamide
CID 117904694

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide (CID 58007240) is 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide is CC(C)NCCOCCN(C)C(=O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide?
The InChIKey is LCGKYHVUQDRDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O2/c1-8(2)14-4-6-17-7-5-15(3)9(16)10(11,12)13/h8,14H,4-7H2,1-3H3.
What are the key properties of 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide?
2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide has a molecular weight of 256.27 g/mol, XLogP of 1.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]acetamide is sourced from PubChem (CID 58007240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).