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

C11H19F3N2O — CID 81388594

IUPAC2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESC[C@@H](NCC(=O)NCC(F)(F)F)C1CCCC1
InChIInChI=1S/C11H19F3N2O/c1-8(9-4-2-3-5-9)15-6-10(17)16-7-11(12,13)14/h8-9,15H,2-7H2,1H3,(H,16,17)/t8-/m1/s1
InChIKeyKYMUAWODEWDAQS-MRVPVSSYSA-N
MW252.28 g/mol
LogP1.83
Rot. Bonds5

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

2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 81388594) has the molecular formula C11H19F3N2O and a molecular weight of 252.28 g/mol. Its IUPAC name is 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID81388594
Molecular FormulaC11H19F3N2O
Molecular Weight252.28 g/mol
Exact Mass252.14
IUPAC Name2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESC[C@@H](NCC(=O)NCC(F)(F)F)C1CCCC1
InChIInChI=1S/C11H19F3N2O/c1-8(9-4-2-3-5-9)15-6-10(17)16-7-11(12,13)14/h8-9,15H,2-7H2,1H3,(H,16,17)/t8-/m1/s1
InChIKeyKYMUAWODEWDAQS-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

2-[[(1R)-1-cycloheptylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 81393575
2-[[(1R)-1-cyclohexylethyl]amino]-N-ethylacetamide
CID 81385685
N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 81389110
N-(1-cyclohexylethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 79005691
2-[[(1R)-1-cycloheptylethyl]amino]-N-propylacetamide
CID 81393570
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 115574953
N-carbamoyl-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393673
N-(cyanomethyl)-2-(1-cyclohexylethylamino)acetamide
CID 62407707
N-(cyanomethyl)-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393576
N-tert-butyl-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393192
N-butyl-2-[[(1R)-1-cyclohexylethyl]amino]acetamide
CID 81384625
2-(1-cyclohexylethylamino)-N-prop-2-enylacetamide
CID 115903241

Frequently Asked Questions

What is the IUPAC name of 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide (CID 81388594) is 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide is C[C@@H](NCC(=O)NCC(F)(F)F)C1CCCC1.
What is the InChIKey of 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is KYMUAWODEWDAQS-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H19F3N2O/c1-8(9-4-2-3-5-9)15-6-10(17)16-7-11(12,13)14/h8-9,15H,2-7H2,1H3,(H,16,17)/t8-/m1/s1.
What are the key properties of 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)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 2-[[(1R)-1-cyclopentylethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 81388594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).