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

C18H21NO2 — CID 888814

IUPAC(2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)NCc2ccccc2)c1C
InChIInChI=1S/C18H21NO2/c1-13-8-7-11-17(14(13)2)21-15(3)18(20)19-12-16-9-5-4-6-10-16/h4-11,15H,12H2,1-3H3,(H,19,20)/t15-/m1/s1
InChIKeyFOENRTWPSGONRF-OAHLLOKOSA-N
MW283.37 g/mol
LogP3.39
Rot. Bonds5

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

(2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide (PubChem CID 888814) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is (2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide
PubChem CID888814
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name(2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)NCc2ccccc2)c1C
InChIInChI=1S/C18H21NO2/c1-13-8-7-11-17(14(13)2)21-15(3)18(20)19-12-16-9-5-4-6-10-16/h4-11,15H,12H2,1-3H3,(H,19,20)/t15-/m1/s1
InChIKeyFOENRTWPSGONRF-OAHLLOKOSA-N
XLogP3.39
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-[(4-chlorophenyl)methyl]-2-(2,3-dimethylphenoxy)propanamide
CID 26546234
2-(2,3-dimethylphenoxy)-N-(naphthalen-1-ylmethyl)propanamide
CID 133218986
(2S)-2-(2,3-dimethylphenoxy)-N-[(3-ethoxyphenyl)methyl]propanamide
CID 99131504
2-(2,3-dimethylphenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide
CID 132656072
2-(2,3-dimethylphenoxy)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide
CID 46767407
2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide
CID 43885247
N'-[2-(2,3-dimethylphenoxy)propanoyl]-2-phenylmethoxypropanehydrazide
CID 55650544
(2R)-N-benzyl-2-(2,3-dichlorophenoxy)propanamide
CID 7542636
2-(2,3-dimethylphenoxy)-N-phenylpropanamide
CID 43909351
2-(2,3-dimethylphenoxy)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide
CID 43077961
(2R)-2-(2,3-dimethylphenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 39710056
N-benzyl-2-(2-butan-2-ylphenoxy)propanamide
CID 17129862

Frequently Asked Questions

What is the IUPAC name of (2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide?
The IUPAC name of (2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide (CID 888814) is (2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide?
The canonical SMILES for (2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide is Cc1cccc(O[C@H](C)C(=O)NCc2ccccc2)c1C.
What is the InChIKey of (2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide?
The InChIKey is FOENRTWPSGONRF-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H21NO2/c1-13-8-7-11-17(14(13)2)21-15(3)18(20)19-12-16-9-5-4-6-10-16/h4-11,15H,12H2,1-3H3,(H,19,20)/t15-/m1/s1.
What are the key properties of (2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide?
(2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide has a molecular weight of 283.37 g/mol, XLogP of 3.39, 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-dimethylphenoxy)propanamide is sourced from PubChem (CID 888814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).