(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide

C11H14ClFN2O — CID 107570747

IUPAC(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1c(F)cccc1Cl
InChIInChI=1S/C11H14ClFN2O/c1-2-4-9(14)11(16)15-10-7(12)5-3-6-8(10)13/h3,5-6,9H,2,4,14H2,1H3,(H,15,16)/t9-/m1/s1
InChIKeyFDSBCXOSPRXNDY-SECBINFHSA-N
MW244.70 g/mol
LogP2.55
Rot. Bonds4

About (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide

(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide (PubChem CID 107570747) has the molecular formula C11H14ClFN2O and a molecular weight of 244.70 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide
PubChem CID107570747
Molecular FormulaC11H14ClFN2O
Molecular Weight244.70 g/mol
Exact Mass244.08
IUPAC Name(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1c(F)cccc1Cl
InChIInChI=1S/C11H14ClFN2O/c1-2-4-9(14)11(16)15-10-7(12)5-3-6-8(10)13/h3,5-6,9H,2,4,14H2,1H3,(H,15,16)/t9-/m1/s1
InChIKeyFDSBCXOSPRXNDY-SECBINFHSA-N
XLogP2.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.70
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2-chloro-6-methylphenyl)pentanamide
CID 66254750
2-amino-N-(2,6-difluorophenyl)hexanamide
CID 54928730
(2S)-2-amino-N-(2-chloro-6-fluorophenyl)propanamide
CID 104877858
2-amino-N-[1-(2-chloro-6-fluorophenyl)ethyl]pentanamide
CID 119343650
(2S)-2-amino-N-(2-fluoro-6-methylphenyl)hexanamide
CID 107146650
(2S)-2-amino-N-(2-chloro-6-methylphenyl)hexanamide
CID 107145880
2-amino-N-(3-chloro-4-fluorophenyl)pentanamide
CID 43650208
2-amino-N-(2,4,6-trichlorophenyl)pentanamide
CID 43650225
2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide
CID 65467824
3-amino-N-(2-chloro-6-fluorophenyl)-2-methoxypropanamide
CID 106113926
(2R)-2-amino-N-(2,3,4,5,6-pentafluorophenyl)pentanamide
CID 107570332
3-(2-chloro-6-fluoroanilino)-2-methyl-3-oxopropanoic acid
CID 114899076

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide?
The IUPAC name of (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide (CID 107570747) is (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide is CCC[C@@H](N)C(=O)Nc1c(F)cccc1Cl.
What is the InChIKey of (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide?
The InChIKey is FDSBCXOSPRXNDY-SECBINFHSA-N. The full InChI is InChI=1S/C11H14ClFN2O/c1-2-4-9(14)11(16)15-10-7(12)5-3-6-8(10)13/h3,5-6,9H,2,4,14H2,1H3,(H,15,16)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide?
(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide has a molecular weight of 244.70 g/mol, XLogP of 2.55, 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-chloro-6-fluorophenyl)pentanamide is sourced from PubChem (CID 107570747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).