(2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide

C16H15Cl2NO2 — CID 7542636

IUPAC(2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide
SMILESC[C@@H](Oc1cccc(Cl)c1Cl)C(=O)NCc1ccccc1
InChIInChI=1S/C16H15Cl2NO2/c1-11(21-14-9-5-8-13(17)15(14)18)16(20)19-10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3,(H,19,20)/t11-/m1/s1
InChIKeyDOQYBPCSUCXXTN-LLVKDONJSA-N
MW324.21 g/mol
LogP4.08
Rot. Bonds5

About (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide

(2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide (PubChem CID 7542636) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide
PubChem CID7542636
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name(2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide
SMILESC[C@@H](Oc1cccc(Cl)c1Cl)C(=O)NCc1ccccc1
InChIInChI=1S/C16H15Cl2NO2/c1-11(21-14-9-5-8-13(17)15(14)18)16(20)19-10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3,(H,19,20)/t11-/m1/s1
InChIKeyDOQYBPCSUCXXTN-LLVKDONJSA-N
XLogP4.08
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 ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(2-chlorophenoxy)-N-[(4-fluorophenyl)methyl]propanamide
CID 26529894
(2S)-2-(2,3-dichlorophenoxy)-N-[(2R)-2-phenylpropyl]propanamide
CID 8604307
(2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide
CID 888814
2-(2,3-dichlorophenoxy)-N-(2-phenoxyethyl)propanamide
CID 55686865
(2S)-2-(2-chlorophenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 28635676
2-(2-chlorophenoxy)-N-[[4-(dimethylamino)phenyl]methyl]propanamide
CID 53282907
2-(2,3-dichlorophenoxy)-N-(2-methoxyethyl)propanamide
CID 46452752
(2S)-2-(2-chlorophenoxy)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide
CID 94015153
N-benzyl-2-(2-butan-2-ylphenoxy)propanamide
CID 17129862
N-benzyl-2-(2-bromo-4-chlorophenoxy)propanamide
CID 4981350
2-(2-chlorophenoxy)-N-[[3-(piperidin-1-ylmethyl)phenyl]methyl]propanamide
CID 133189350
(2S)-N-[(4-chlorophenyl)methyl]-2-(2,3-dimethylphenoxy)propanamide
CID 26546234

Frequently Asked Questions

What is the IUPAC name of (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide?
The IUPAC name of (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide (CID 7542636) is (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide.
What is the SMILES notation for (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide?
The canonical SMILES for (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide is C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)NCc1ccccc1.
What is the InChIKey of (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide?
The InChIKey is DOQYBPCSUCXXTN-LLVKDONJSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-11(21-14-9-5-8-13(17)15(14)18)16(20)19-10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3,(H,19,20)/t11-/m1/s1.
What are the key properties of (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide?
(2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide has a molecular weight of 324.21 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide is sourced from PubChem (CID 7542636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).