(2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide

C19H19N3O3 — CID 40871308

IUPAC(2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)Nc2nonc2-c2ccccc2)c1C
InChIInChI=1S/C19H19N3O3/c1-12-8-7-11-16(13(12)2)24-14(3)19(23)20-18-17(21-25-22-18)15-9-5-4-6-10-15/h4-11,14H,1-3H3,(H,20,22,23)/t14-/m1/s1
InChIKeyGDXKYURMZBAPAV-CQSZACIVSA-N
MW337.38 g/mol
LogP3.76
Rot. Bonds5

About (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide

(2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide (PubChem CID 40871308) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide
PubChem CID40871308
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name(2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)Nc2nonc2-c2ccccc2)c1C
InChIInChI=1S/C19H19N3O3/c1-12-8-7-11-16(13(12)2)24-14(3)19(23)20-18-17(21-25-22-18)15-9-5-4-6-10-15/h4-11,14H,1-3H3,(H,20,22,23)/t14-/m1/s1
InChIKeyGDXKYURMZBAPAV-CQSZACIVSA-N
XLogP3.76
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,3-dimethylphenoxy)-N-[4-(4-ethoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]propanamide
CID 43843037
2-(2,3-dimethylphenoxy)-N-phenylpropanamide
CID 43909351
(2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide
CID 42278337
2-(2-fluorophenoxy)-N-[4-(4-methoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]propanamide
CID 17014047
(2R)-2-(2-chlorophenoxy)-N-[4-(4-methoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]propanamide
CID 35126360
(2S)-2-(2,3-dimethylphenoxy)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)propanamide
CID 38928174
(2S)-N-[4-(4-ethoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]-2-(2-methoxyphenoxy)propanamide
CID 35129395
2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide
CID 17249224
2-(2-chlorophenoxy)-N-[4-(4-ethoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]propanamide
CID 43842833
(2S)-2-(2,3-dimethylphenoxy)-N-(2,3-dimethylphenyl)propanamide
CID 28574303
(2R)-2-(2-fluorophenoxy)-N-[4-(4-prop-2-enoxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide
CID 42535712
2-(2,3-dimethylphenoxy)-N-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]propanamide
CID 46299621

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide?
The IUPAC name of (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide (CID 40871308) is (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide.
What is the SMILES notation for (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide?
The canonical SMILES for (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide is Cc1cccc(O[C@H](C)C(=O)Nc2nonc2-c2ccccc2)c1C.
What is the InChIKey of (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide?
The InChIKey is GDXKYURMZBAPAV-CQSZACIVSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-12-8-7-11-16(13(12)2)24-14(3)19(23)20-18-17(21-25-22-18)15-9-5-4-6-10-15/h4-11,14H,1-3H3,(H,20,22,23)/t14-/m1/s1.
What are the key properties of (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide?
(2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide has a molecular weight of 337.38 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide is sourced from PubChem (CID 40871308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).