N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide

C9H14F3NOS — CID 51078914

IUPACN-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide
SMILESCC(C1CC1)N(C)C(=O)CSC(F)(F)F
InChIInChI=1S/C9H14F3NOS/c1-6(7-3-4-7)13(2)8(14)5-15-9(10,11)12/h6-7H,3-5H2,1-2H3
InChIKeyVVIWXMAHNPFCNU-UHFFFAOYSA-N
MW241.28 g/mol
LogP2.50
Rot. Bonds4

About N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide

N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide (PubChem CID 51078914) has the molecular formula C9H14F3NOS and a molecular weight of 241.28 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide
PubChem CID51078914
Molecular FormulaC9H14F3NOS
Molecular Weight241.28 g/mol
Exact Mass241.07
IUPAC NameN-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide
SMILESCC(C1CC1)N(C)C(=O)CSC(F)(F)F
InChIInChI=1S/C9H14F3NOS/c1-6(7-3-4-7)13(2)8(14)5-15-9(10,11)12/h6-7H,3-5H2,1-2H3
InChIKeyVVIWXMAHNPFCNU-UHFFFAOYSA-N
XLogP2.50
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.28
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-N-[(1S)-1-cyclopropylethyl]-4,4,4-trifluoro-N-methyl-3-phenylbutanamide
CID 95336409
1-(1-cyclopropylethyl)-1-methylurea
CID 43420591
N-[(1R)-1-cyclopropylethyl]-2-(1,3-dioxoisoindol-2-yl)-N-methylacetamide
CID 51547425
2-[2-[1-cyclopropylethyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]sulfanylacetic acid
CID 112682892
N-[(1R)-1-cyclopropylethyl]-N-methylcyclopropanecarboxamide
CID 52519617
N-(1-cyclopropylethyl)-N,2-dimethylcyclopropane-1-carboxamide
CID 51112711
2-tert-butylsulfanyl-N-methyl-N-propan-2-ylacetamide
CID 78814922
3-[(3aR,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[(1R)-1-cyclopropylethyl]-N-methylpropanamide
CID 98377628
2-(4-aminophenyl)-N-(1-cyclopropylethyl)-N-methylacetamide
CID 43568614
1-[4-(1-aminoethyl)piperidin-1-yl]-2-(trifluoromethylsulfanyl)ethanone;hydrochloride
CID 119517514
N-[(1S)-1-cyclopropylethyl]-N-methylcyclopentanecarboxamide
CID 52522891
2-[1-(aminomethyl)cyclohexyl]-N-(1-cyclopropylethyl)-N-methylacetamide
CID 104677614

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide?
The IUPAC name of N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide (CID 51078914) is N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide?
The canonical SMILES for N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide is CC(C1CC1)N(C)C(=O)CSC(F)(F)F.
What is the InChIKey of N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide?
The InChIKey is VVIWXMAHNPFCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3NOS/c1-6(7-3-4-7)13(2)8(14)5-15-9(10,11)12/h6-7H,3-5H2,1-2H3.
What are the key properties of N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide?
N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide has a molecular weight of 241.28 g/mol, XLogP of 2.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N-methyl-2-(trifluoromethylsulfanyl)acetamide is sourced from PubChem (CID 51078914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).