N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide

C11H19F3N2O — CID 81389110

IUPACN-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESC[C@@H](NC(=O)CNCC(F)(F)F)C1CCCC1
InChIInChI=1S/C11H19F3N2O/c1-8(9-4-2-3-5-9)16-10(17)6-15-7-11(12,13)14/h8-9,15H,2-7H2,1H3,(H,16,17)/t8-/m1/s1
InChIKeyNYOHGYPLAJUJKG-MRVPVSSYSA-N
MW252.28 g/mol
LogP1.83
Rot. Bonds5

About N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide

N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 81389110) has the molecular formula C11H19F3N2O and a molecular weight of 252.28 g/mol. Its IUPAC name is N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID81389110
Molecular FormulaC11H19F3N2O
Molecular Weight252.28 g/mol
Exact Mass252.14
IUPAC NameN-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESC[C@@H](NC(=O)CNCC(F)(F)F)C1CCCC1
InChIInChI=1S/C11H19F3N2O/c1-8(9-4-2-3-5-9)16-10(17)6-15-7-11(12,13)14/h8-9,15H,2-7H2,1H3,(H,16,17)/t8-/m1/s1
InChIKeyNYOHGYPLAJUJKG-MRVPVSSYSA-N
XLogP1.83
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclohexylethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 79005691
2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 81388594
2-[[(1R)-1-cycloheptylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 81393575
N-[(1S)-1-cycloheptylethyl]-2-(propylamino)acetamide
CID 81393460
N-[(1R)-1-cyclopentylethyl]-2-(prop-2-enylamino)acetamide
CID 81388659
N-[(1S)-1-cyclopentylethyl]-2-(prop-2-enylamino)acetamide
CID 81388626
2-(cyclopentylamino)-N-[(1R)-1-cyclopentylethyl]acetamide
CID 81389612
N-(2-propan-2-ylcyclohexyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958094
N-[(1R)-1-cycloheptylethyl]-2-(2-methoxyethylamino)acetamide
CID 81393093
N,N'-bis[(1S)-1-cyclohexylethyl]butanediamide
CID 132596983
N-[(2R)-1-hydroxypropan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 107218513
N-(1-piperidin-1-ylpropan-2-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958032

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide (CID 81389110) is N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide is C[C@@H](NC(=O)CNCC(F)(F)F)C1CCCC1.
What is the InChIKey of N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is NYOHGYPLAJUJKG-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H19F3N2O/c1-8(9-4-2-3-5-9)16-10(17)6-15-7-11(12,13)14/h8-9,15H,2-7H2,1H3,(H,16,17)/t8-/m1/s1.
What are the key properties of N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 252.28 g/mol, XLogP of 1.83, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 81389110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).