(2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide

C11H11F5N2O — CID 107570332

IUPAC(2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C11H11F5N2O/c1-2-3-4(17)11(19)18-10-8(15)6(13)5(12)7(14)9(10)16/h4H,2-3,17H2,1H3,(H,18,19)/t4-/m1/s1
InChIKeyCKQVZOYZVYVPQB-SCSAIBSYSA-N
MW282.21 g/mol
LogP2.45
Rot. Bonds4

About (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide

(2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide (PubChem CID 107570332) has the molecular formula C11H11F5N2O and a molecular weight of 282.21 g/mol. Its IUPAC name is (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide
PubChem CID107570332
Molecular FormulaC11H11F5N2O
Molecular Weight282.21 g/mol
Exact Mass282.08
IUPAC Name(2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C11H11F5N2O/c1-2-3-4(17)11(19)18-10-8(15)6(13)5(12)7(14)9(10)16/h4H,2-3,17H2,1H3,(H,18,19)/t4-/m1/s1
InChIKeyCKQVZOYZVYVPQB-SCSAIBSYSA-N
XLogP2.45
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.21
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-(aminomethyl)-N-(2,3,4,5,6-pentafluorophenyl)pentanamide
CID 115564259
(2S)-2-amino-4-methyl-N-(2,3,4,5,6-pentafluorophenyl)pentanamide
CID 115564487
2-amino-N-(3,4,5-trifluorophenyl)pentanamide
CID 62814039
(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide
CID 107570747
2-amino-N-(2,4,6-trichlorophenyl)pentanamide
CID 43650225
(2S)-2-amino-N-(2,4,6-tribromophenyl)pentanamide
CID 107568149
(2S)-2-amino-N-(2,3,5-trifluorophenyl)pentanamide
CID 94872912
4-amino-2-methyl-N-(2,3,4,5,6-pentafluorophenyl)butanamide
CID 115564436
2-amino-N-(2,6-difluorophenyl)hexanamide
CID 54928730
(2S)-2-amino-N-(2,4,6-trifluorophenyl)hexanamide
CID 107145817
(2S)-2-amino-N-(2,6-dichloro-4-methyl-3-pyridinyl)pentanamide
CID 114051376
2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)pentanamide
CID 54863652

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide?
The IUPAC name of (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide (CID 107570332) is (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide is CCC[C@@H](N)C(=O)Nc1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide?
The InChIKey is CKQVZOYZVYVPQB-SCSAIBSYSA-N. The full InChI is InChI=1S/C11H11F5N2O/c1-2-3-4(17)11(19)18-10-8(15)6(13)5(12)7(14)9(10)16/h4H,2-3,17H2,1H3,(H,18,19)/t4-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide?
(2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide has a molecular weight of 282.21 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide is sourced from PubChem (CID 107570332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).