3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide

C8H14F3NO2 — CID 144653521

IUPAC3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide
SMILESCOCC(C)C(=O)NC(C)C(F)(F)F
InChIInChI=1S/C8H14F3NO2/c1-5(4-14-3)7(13)12-6(2)8(9,10)11/h5-6H,4H2,1-3H3,(H,12,13)
InChIKeyGPMWXWBFZFSATP-UHFFFAOYSA-N
MW213.20 g/mol
LogP1.34
Rot. Bonds4

About 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide

3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide (PubChem CID 144653521) has the molecular formula C8H14F3NO2 and a molecular weight of 213.20 g/mol. Its IUPAC name is 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide.

Molecular Properties

Compound Name3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide
PubChem CID144653521
Molecular FormulaC8H14F3NO2
Molecular Weight213.20 g/mol
Exact Mass213.10
IUPAC Name3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide
SMILESCOCC(C)C(=O)NC(C)C(F)(F)F
InChIInChI=1S/C8H14F3NO2/c1-5(4-14-3)7(13)12-6(2)8(9,10)11/h5-6H,4H2,1-3H3,(H,12,13)
InChIKeyGPMWXWBFZFSATP-UHFFFAOYSA-N
XLogP1.34
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methoxy-N-(propan-2-yl)propanamide
CID 59304258
N-(3,3-difluorocyclobutyl)-3-methyloxetane-3-carboxamide
CID 132298489
N-(3-aminopropyl)-2,2-dimethyl-3-(1,2,2-trifluoroethoxy)propanamide
CID 58502648
2-Methyl-N-(2,2,2-trifluoro-ethyl)-malonamic acid ethyl ester
CID 86760353
2-methyl-N-(1,1,1-trifluoro-3-methoxypropan-2-yl)propanamide
CID 132224641
2-methyl-N-(1,1,1-trifluoro-4-hydroxybutan-2-yl)propanamide
CID 132250257
N-(2,2-difluoroethyl)-3-methoxy-2-methylpropanamide
CID 144653432
N-propan-2-yl-1-(trifluoromethoxymethyl)cyclopropane-1-carboxamide
CID 167134980
N-[(2R)-3-methylbutan-2-yl]-1-(trifluoromethoxymethyl)cyclopropane-1-carboxamide
CID 167135264
N-(3,3,3-trifluoropropyl)oxetane-3-carboxamide
CID 175933194
ethane;2,2,2-trifluoro-N-[1-(oxetan-3-yl)ethyl]acetamide
CID 177965233
N-[(2R)-butan-2-yl]-3-methoxypropanamide
CID 53496151

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide?
The IUPAC name of 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide (CID 144653521) is 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide.
What is the SMILES notation for 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide?
The canonical SMILES for 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide is COCC(C)C(=O)NC(C)C(F)(F)F.
What is the InChIKey of 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide?
The InChIKey is GPMWXWBFZFSATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO2/c1-5(4-14-3)7(13)12-6(2)8(9,10)11/h5-6H,4H2,1-3H3,(H,12,13).
What are the key properties of 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide?
3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide has a molecular weight of 213.20 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-N-(1,1,1-trifluoropropan-2-yl)propanamide is sourced from PubChem (CID 144653521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).