(2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide

C15H19N3O2S — CID 8558782

IUPAC(2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
SMILESCCOc1ccccc1N[C@H](C)C(=O)Nc1nc(C)cs1
InChIInChI=1S/C15H19N3O2S/c1-4-20-13-8-6-5-7-12(13)17-11(3)14(19)18-15-16-10(2)9-21-15/h5-9,11,17H,4H2,1-3H3,(H,16,18,19)/t11-/m1/s1
InChIKeyJWXIXZBLIKKERI-LLVKDONJSA-N
MW305.40 g/mol
LogP3.29
Rot. Bonds6

About (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide

(2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide (PubChem CID 8558782) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
PubChem CID8558782
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name(2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
SMILESCCOc1ccccc1N[C@H](C)C(=O)Nc1nc(C)cs1
InChIInChI=1S/C15H19N3O2S/c1-4-20-13-8-6-5-7-12(13)17-11(3)14(19)18-15-16-10(2)9-21-15/h5-9,11,17H,4H2,1-3H3,(H,16,18,19)/t11-/m1/s1
InChIKeyJWXIXZBLIKKERI-LLVKDONJSA-N
XLogP3.29
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-(2-ethoxyanilino)-N-(1,3-thiazol-2-yl)propanamide
CID 7450130
2-(2-ethoxyanilino)-N-methylpropanamide
CID 43085473
4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide
CID 2679260
(2S)-2-(2,5-dimethylanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 8558262
(2S)-2-(2-ethoxyanilino)propanoic acid
CID 40788292
N-(4-methyl-1,3-thiazol-2-yl)-2-(2-propan-2-ylphenoxy)acetamide
CID 7770883
2-(2-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 155976896
2-(4-ethoxyanilino)-N-(2-ethoxyphenyl)propanamide
CID 51242376
N-(2-ethoxyphenyl)-2-(3-methylanilino)propanamide
CID 51242335
(2S)-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methoxyanilino)propanamide
CID 28824897
2-[1-(2-ethoxyanilino)-1-oxopropan-2-yl]-1,3-thiazole-4-carboxylic acid
CID 16642338
N-(4-methyl-1,3-thiazol-2-yl)-2-phenoxypropanamide
CID 4162363

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide (CID 8558782) is (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide is CCOc1ccccc1N[C@H](C)C(=O)Nc1nc(C)cs1.
What is the InChIKey of (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is JWXIXZBLIKKERI-LLVKDONJSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-4-20-13-8-6-5-7-12(13)17-11(3)14(19)18-15-16-10(2)9-21-15/h5-9,11,17H,4H2,1-3H3,(H,16,18,19)/t11-/m1/s1.
What are the key properties of (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide?
(2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 305.40 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 8558782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).