(2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide

C16H15Cl2NO2 — CID 7890128

IUPAC(2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide
SMILESCC[C@@H](Oc1ccccc1)C(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C16H15Cl2NO2/c1-2-14(21-11-7-4-3-5-8-11)16(20)19-15-12(17)9-6-10-13(15)18/h3-10,14H,2H2,1H3,(H,19,20)/t14-/m1/s1
InChIKeyKRUCTVYBBWXSMB-CQSZACIVSA-N
MW324.21 g/mol
LogP4.79
Rot. Bonds5

About (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide

(2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide (PubChem CID 7890128) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide.

Molecular Properties

Compound Name(2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide
PubChem CID7890128
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name(2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide
SMILESCC[C@@H](Oc1ccccc1)C(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C16H15Cl2NO2/c1-2-14(21-11-7-4-3-5-8-11)16(20)19-15-12(17)9-6-10-13(15)18/h3-10,14H,2H2,1H3,(H,19,20)/t14-/m1/s1
InChIKeyKRUCTVYBBWXSMB-CQSZACIVSA-N
XLogP4.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(2,6-dichlorophenyl)-2-(3-methoxyphenoxy)butanamide
CID 28577552
N-(3,5-dichlorophenyl)-2-phenoxybutanamide
CID 4099409
N-(2,5-dichlorophenyl)-2-phenoxybutanamide
CID 2886435
(2R)-2-phenoxy-N-[2-[[(2R)-2-phenoxybutanoyl]amino]ethyl]butanamide
CID 7308794
(2S)-2-phenoxy-N-[2-[[(2S)-2-phenoxybutanoyl]amino]ethyl]butanamide
CID 7308795
(2R)-2-phenoxy-N-[2-[[(2S)-2-phenoxybutanoyl]amino]ethyl]butanamide
CID 7308793
(2R)-2-phenoxy-N-pyrimidin-2-ylbutanamide
CID 873676
(2S)-N-(3-chloro-4-fluorophenyl)-2-phenoxybutanamide
CID 673599
(2R)-N-naphthalen-1-yl-2-phenoxybutanamide
CID 904123
(2R)-2-(2-chlorophenoxy)-N-(2,6-difluorophenyl)butanamide
CID 38002090
N-(2-chlorophenyl)-2-(4-fluorophenoxy)butanamide
CID 46771035
methyl 2-chloro-5-[[(2R)-2-phenoxybutanoyl]amino]benzoate
CID 40747377

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide?
The IUPAC name of (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide (CID 7890128) is (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide.
What is the SMILES notation for (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide?
The canonical SMILES for (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide is CC[C@@H](Oc1ccccc1)C(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide?
The InChIKey is KRUCTVYBBWXSMB-CQSZACIVSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-2-14(21-11-7-4-3-5-8-11)16(20)19-15-12(17)9-6-10-13(15)18/h3-10,14H,2H2,1H3,(H,19,20)/t14-/m1/s1.
What are the key properties of (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide?
(2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide has a molecular weight of 324.21 g/mol, XLogP of 4.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,6-dichlorophenyl)-2-phenoxybutanamide is sourced from PubChem (CID 7890128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).