N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide

C11H17F3N2O — CID 103839402

IUPACN-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESO=C(CNCC(F)(F)F)NCC1(C2CC2)CC1
InChIInChI=1S/C11H17F3N2O/c12-11(13,14)7-15-5-9(17)16-6-10(3-4-10)8-1-2-8/h8,15H,1-7H2,(H,16,17)
InChIKeyVFRJEAUBHYWIKT-UHFFFAOYSA-N
MW250.26 g/mol
LogP1.44
Rot. Bonds6

About N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide

N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 103839402) has the molecular formula C11H17F3N2O and a molecular weight of 250.26 g/mol. Its IUPAC name is N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID103839402
Molecular FormulaC11H17F3N2O
Molecular Weight250.26 g/mol
Exact Mass250.13
IUPAC NameN-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESO=C(CNCC(F)(F)F)NCC1(C2CC2)CC1
InChIInChI=1S/C11H17F3N2O/c12-11(13,14)7-15-5-9(17)16-6-10(3-4-10)8-1-2-8/h8,15H,1-7H2,(H,16,17)
InChIKeyVFRJEAUBHYWIKT-UHFFFAOYSA-N
XLogP1.44
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(hydroxymethyl)cyclohexyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 112699710
1-[[[2-(2,2,2-trifluoroethylamino)acetyl]amino]methyl]cyclopropane-1-carboxylic acid
CID 113312278
N-[(1-hydroxy-3-methylcyclohexyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 79039779
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 103801700
N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78924304
2-[[1-(hydroxymethyl)cyclopropyl]methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 115454888
N-ethyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 28595910
ethyl 4-[(1-cyclopropylcyclopropyl)methylamino]-4-oxobutanoate
CID 103839272
N-[(1-cyclopropylcyclobutyl)methyl]-5-oxo-1-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 71844671
N-(thiolan-3-ylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 107296147
N-(2-oxo-2-pyrrolidin-1-ylethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 113235197
1-cyano-N-[(1-cyclopropylcyclopropyl)methyl]cyclobutane-1-carboxamide
CID 103839419

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide (CID 103839402) is N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide is O=C(CNCC(F)(F)F)NCC1(C2CC2)CC1.
What is the InChIKey of N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is VFRJEAUBHYWIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3N2O/c12-11(13,14)7-15-5-9(17)16-6-10(3-4-10)8-1-2-8/h8,15H,1-7H2,(H,16,17).
What are the key properties of N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide?
N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 250.26 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 103839402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).