(2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide

C10H19F3N2O — CID 104903332

IUPAC(2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide
SMILESCCN(CC(F)(F)F)C(=O)[C@H](N)CC(C)C
InChIInChI=1S/C10H19F3N2O/c1-4-15(6-10(11,12)13)9(16)8(14)5-7(2)3/h7-8H,4-6,14H2,1-3H3/t8-/m1/s1
InChIKeyWSDQGBLLBLUVEX-MRVPVSSYSA-N
MW240.27 g/mol
LogP1.77
Rot. Bonds5

About (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide

(2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide (PubChem CID 104903332) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide
PubChem CID104903332
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name(2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide
SMILESCCN(CC(F)(F)F)C(=O)[C@H](N)CC(C)C
InChIInChI=1S/C10H19F3N2O/c1-4-15(6-10(11,12)13)9(16)8(14)5-7(2)3/h7-8H,4-6,14H2,1-3H3/t8-/m1/s1
InChIKeyWSDQGBLLBLUVEX-MRVPVSSYSA-N
XLogP1.77
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N,N-diethyl-4-methylpentanamide
CID 24697294
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide
CID 61164150
(2R)-2-amino-4-methyl-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)pentanamide
CID 93372320
2-amino-N-ethyl-4-methyl-N-prop-2-enylpentanamide
CID 81489014
2-amino-N-(cyclopropylmethyl)-N-ethyl-4-methylpentanamide
CID 63954154
(2R)-2-amino-N-[3-(dimethylamino)propyl]-N-ethyl-4-methylpentanamide
CID 102992753
(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide
CID 102993062
2-[2-aminobutanoyl(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258497
3-amino-N-ethyl-2-methyl-3-phenyl-N-(2,2,2-trifluoroethyl)propanamide
CID 80552219
(2S)-2-amino-N,N-bis(2-amino-2-oxoethyl)-4-methylpentanamide
CID 62922094
(2S)-2-amino-N-[(2,6-difluorophenyl)methyl]-N-ethyl-4-methylpentanamide
CID 119767637
(2S)-2-amino-N-propyl-N-(2,2,2-trifluoroethyl)propanamide
CID 61146661

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide?
The IUPAC name of (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide (CID 104903332) is (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide is CCN(CC(F)(F)F)C(=O)[C@H](N)CC(C)C.
What is the InChIKey of (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide?
The InChIKey is WSDQGBLLBLUVEX-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-4-15(6-10(11,12)13)9(16)8(14)5-7(2)3/h7-8H,4-6,14H2,1-3H3/t8-/m1/s1.
What are the key properties of (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide?
(2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide has a molecular weight of 240.27 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide is sourced from PubChem (CID 104903332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).