2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide

C9H14F3NO2 — CID 103801703

IUPAC2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
SMILESCOCCC1(CNC(=O)C(F)(F)F)CC1
InChIInChI=1S/C9H14F3NO2/c1-15-5-4-8(2-3-8)6-13-7(14)9(10,11)12/h2-6H2,1H3,(H,13,14)
InChIKeyRKGGDVSAIIQKKL-UHFFFAOYSA-N
MW225.21 g/mol
LogP1.48
Rot. Bonds5

About 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide

2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide (PubChem CID 103801703) has the molecular formula C9H14F3NO2 and a molecular weight of 225.21 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
PubChem CID103801703
Molecular FormulaC9H14F3NO2
Molecular Weight225.21 g/mol
Exact Mass225.10
IUPAC Name2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
SMILESCOCCC1(CNC(=O)C(F)(F)F)CC1
InChIInChI=1S/C9H14F3NO2/c1-15-5-4-8(2-3-8)6-13-7(14)9(10,11)12/h2-6H2,1H3,(H,13,14)
InChIKeyRKGGDVSAIIQKKL-UHFFFAOYSA-N
XLogP1.48
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.21
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-difluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]acetamide
CID 103514010
N-[(1-ethylcyclopropyl)methyl]-2,2,2-trifluoroacetamide
CID 103737219
2,2,2-trifluoro-N-[(4-methyloxan-4-yl)methyl]acetamide
CID 103742631
2,2,2-trifluoroethyl N-[[1-(2-methoxyethyl)cyclopropyl]methyl]carbamate
CID 103793594
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 103801700
2,2,3,3-tetrafluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]propanamide
CID 103804719
2,2,2-trifluoro-N-(4-methoxy-2,2-dimethylbutyl)acetamide
CID 104625819
2,2,3,3-tetrafluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide
CID 104957568
2-[[1-(2-methoxyethyl)cyclopropyl]methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 105791104
2-amino-3,3,3-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpropanamide
CID 105791417
2,2,3,3,3-pentafluoro-N-(4-methoxy-2,2-dimethylbutyl)propanamide
CID 105901267
2,2,3,3,3-pentafluoro-N-[(4-methyloxan-4-yl)methyl]propanamide
CID 105901273

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide (CID 103801703) is 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide is COCCC1(CNC(=O)C(F)(F)F)CC1.
What is the InChIKey of 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide?
The InChIKey is RKGGDVSAIIQKKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3NO2/c1-15-5-4-8(2-3-8)6-13-7(14)9(10,11)12/h2-6H2,1H3,(H,13,14).
What are the key properties of 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide?
2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide has a molecular weight of 225.21 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide is sourced from PubChem (CID 103801703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).