N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide

C12H21F3N2O2 — CID 78958153

IUPACN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCOCCN(C(=O)CNCC(F)(F)F)C(C)C1CC1
InChIInChI=1S/C12H21F3N2O2/c1-9(10-3-4-10)17(5-6-19-2)11(18)7-16-8-12(13,14)15/h9-10,16H,3-8H2,1-2H3
InChIKeyTZZOYGJROWSFKM-UHFFFAOYSA-N
MW282.31 g/mol
LogP1.41
Rot. Bonds8

About N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide

N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 78958153) has the molecular formula C12H21F3N2O2 and a molecular weight of 282.31 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID78958153
Molecular FormulaC12H21F3N2O2
Molecular Weight282.31 g/mol
Exact Mass282.16
IUPAC NameN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCOCCN(C(=O)CNCC(F)(F)F)C(C)C1CC1
InChIInChI=1S/C12H21F3N2O2/c1-9(10-3-4-10)17(5-6-19-2)11(18)7-16-8-12(13,14)15/h9-10,16H,3-8H2,1-2H3
InChIKeyTZZOYGJROWSFKM-UHFFFAOYSA-N
XLogP1.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Cambridge id 5488718
CID 2849065
N-(1-methoxypropan-2-yl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 45796840
N-(1-cyclopropylethyl)-2-[(4-methylmorpholin-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 53581463
2-amino-N-[2-[1-cyclopropylethyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]acetamide
CID 54870045
2-(cyclopropylmethylamino)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 54872184
2-[(3-amino-1,1,1-trifluoropropan-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 54989201
2-[(4-amino-1,1,1-trifluorobutan-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 54989313
N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide
CID 55259535
N-pentan-3-yl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide
CID 55261840
N-cyclopropyl-2-[2-methoxyethyl(2,2,2-trifluoroethyl)amino]acetamide
CID 60303341
N-(1-cyclopropylethyl)-2-(propan-2-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60683035
2-(butan-2-ylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 60684326

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide (CID 78958153) is N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide is COCCN(C(=O)CNCC(F)(F)F)C(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is TZZOYGJROWSFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O2/c1-9(10-3-4-10)17(5-6-19-2)11(18)7-16-8-12(13,14)15/h9-10,16H,3-8H2,1-2H3.
What are the key properties of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide?
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 282.31 g/mol, XLogP of 1.41, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 78958153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).