(2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide

C8H15F3N2O — CID 107568767

IUPAC(2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide
SMILESCCC[C@@H](N)C(=O)N(C)CC(F)(F)F
InChIInChI=1S/C8H15F3N2O/c1-3-4-6(12)7(14)13(2)5-8(9,10)11/h6H,3-5,12H2,1-2H3/t6-/m1/s1
InChIKeyMDBYNPODAPEQIV-ZCFIWIBFSA-N
MW212.21 g/mol
LogP1.13
Rot. Bonds4

About (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide

(2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide (PubChem CID 107568767) has the molecular formula C8H15F3N2O and a molecular weight of 212.21 g/mol. Its IUPAC name is (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide
PubChem CID107568767
Molecular FormulaC8H15F3N2O
Molecular Weight212.21 g/mol
Exact Mass212.11
IUPAC Name(2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide
SMILESCCC[C@@H](N)C(=O)N(C)CC(F)(F)F
InChIInChI=1S/C8H15F3N2O/c1-3-4-6(12)7(14)13(2)5-8(9,10)11/h6H,3-5,12H2,1-2H3/t6-/m1/s1
InChIKeyMDBYNPODAPEQIV-ZCFIWIBFSA-N
XLogP1.13
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-5-[methyl(2,2,2-trifluoroethyl)amino]-5-oxopentanoic acid
CID 64890077
(2R)-2-amino-N-ethyl-N-methylpentanamide
CID 93255557
(2S)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 61146828
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylpentanamide
CID 107568202
2-amino-N-methyl-N-(3-methylbutyl)pentanamide
CID 60963800
(2R)-2-amino-N-hydroxy-N-methylpentanamide
CID 131057070
(2S)-2-amino-N-[3-(dimethylamino)propyl]-N-methylpentanamide
CID 107569740
2-amino-N-benzyl-N-(2,2,2-trifluoroethyl)pentanamide
CID 60938216
(2S)-2-amino-N-propan-2-yl-N-(2,2,2-trifluoroethyl)hexanamide
CID 107144500
2-amino-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)hexanamide
CID 54872172
(2S)-2-amino-N-methyl-N-(2-methylsulfonylethyl)pentanamide
CID 107570108
2-amino-N-(2-ethoxyethyl)-N-methylpentanamide
CID 81058843

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide?
The IUPAC name of (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide (CID 107568767) is (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide is CCC[C@@H](N)C(=O)N(C)CC(F)(F)F.
What is the InChIKey of (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide?
The InChIKey is MDBYNPODAPEQIV-ZCFIWIBFSA-N. The full InChI is InChI=1S/C8H15F3N2O/c1-3-4-6(12)7(14)13(2)5-8(9,10)11/h6H,3-5,12H2,1-2H3/t6-/m1/s1.
What are the key properties of (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide?
(2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide has a molecular weight of 212.21 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide is sourced from PubChem (CID 107568767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).