2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide

C11H14Cl2N2O2 — CID 65467824

IUPAC2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide
SMILESCOCCC(N)C(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C11H14Cl2N2O2/c1-17-6-5-9(14)11(16)15-10-7(12)3-2-4-8(10)13/h2-4,9H,5-6,14H2,1H3,(H,15,16)
InChIKeyBEAUIYWYCIPXAC-UHFFFAOYSA-N
MW277.15 g/mol
LogP2.30
Rot. Bonds5

About 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide

2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide (PubChem CID 65467824) has the molecular formula C11H14Cl2N2O2 and a molecular weight of 277.15 g/mol. Its IUPAC name is 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide.

Molecular Properties

Compound Name2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide
PubChem CID65467824
Molecular FormulaC11H14Cl2N2O2
Molecular Weight277.15 g/mol
Exact Mass276.04
IUPAC Name2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide
SMILESCOCCC(N)C(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C11H14Cl2N2O2/c1-17-6-5-9(14)11(16)15-10-7(12)3-2-4-8(10)13/h2-4,9H,5-6,14H2,1H3,(H,15,16)
InChIKeyBEAUIYWYCIPXAC-UHFFFAOYSA-N
XLogP2.30
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.15
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2,6-dichloro-4-fluorophenyl)-4-methoxybutanamide
CID 83079089
2-amino-N-(4-bromo-2,6-dichlorophenyl)-4-methoxybutanamide
CID 62474980
2-amino-N-(2-chloro-6-methylphenyl)pentanamide
CID 66254750
(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide
CID 107570747
2-amino-N-(2-chloro-4-fluorophenyl)-4-methoxybutanamide
CID 55081012
(2S)-2-amino-N-(2-chloro-6-methylphenyl)hexanamide
CID 107145880
2-amino-N-(4-hydroxyphenyl)-4-methoxybutanamide
CID 62472832
2-amino-N-(2-chloro-6-methylphenyl)-4-phenylbutanamide
CID 114928777
methyl 3-[(2-amino-4-methoxybutanoyl)amino]benzoate
CID 62475767
(2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide
CID 66255891
2-[(2-amino-4-methoxybutanoyl)amino]benzamide
CID 55080862
2-amino-N-(2-chloropyrimidin-4-yl)-4-methoxybutanamide
CID 116795128

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide?
The IUPAC name of 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide (CID 65467824) is 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide.
What is the SMILES notation for 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide?
The canonical SMILES for 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide is COCCC(N)C(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide?
The InChIKey is BEAUIYWYCIPXAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2O2/c1-17-6-5-9(14)11(16)15-10-7(12)3-2-4-8(10)13/h2-4,9H,5-6,14H2,1H3,(H,15,16).
What are the key properties of 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide?
2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide has a molecular weight of 277.15 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,6-dichlorophenyl)-4-methoxybutanamide is sourced from PubChem (CID 65467824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).