2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride

C15H20ClN3O3 — CID 119782299

IUPAC2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride
SMILESCOCCNCC(=O)NCc1coc(-c2ccccc2)n1.Cl
InChIInChI=1S/C15H19N3O3.ClH/c1-20-8-7-16-10-14(19)17-9-13-11-21-15(18-13)12-5-3-2-4-6-12;/h2-6,11,16H,7-10H2,1H3,(H,17,19);1H
InChIKeyRDQZSOOLHUMNJU-UHFFFAOYSA-N
MW325.80 g/mol
LogP1.62
Rot. Bonds8

About 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride

2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride (PubChem CID 119782299) has the molecular formula C15H20ClN3O3 and a molecular weight of 325.80 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride
PubChem CID119782299
Molecular FormulaC15H20ClN3O3
Molecular Weight325.80 g/mol
Exact Mass325.12
IUPAC Name2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride
SMILESCOCCNCC(=O)NCc1coc(-c2ccccc2)n1.Cl
InChIInChI=1S/C15H19N3O3.ClH/c1-20-8-7-16-10-14(19)17-9-13-11-21-15(18-13)12-5-3-2-4-6-12;/h2-6,11,16H,7-10H2,1H3,(H,17,19);1H
InChIKeyRDQZSOOLHUMNJU-UHFFFAOYSA-N
XLogP1.62
TPSA76.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.80
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethylamino)-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride
CID 119698131
1-(3-methoxypropyl)-2-methyl-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]guanidine;hydroiodide
CID 111552788
N-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2-methoxyethanamine
CID 60727772
2-(2-methoxyethylamino)-N-(naphthalen-1-ylmethyl)acetamide;hydrochloride
CID 119709577
methyl 3-[[N'-methyl-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]carbamimidoyl]amino]propanoate
CID 111551824
2-methoxy-N-[(2-naphthalen-2-yl-1,3-oxazol-4-yl)methyl]ethanamine
CID 65288455
2-(2-methoxyethylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide;dihydrochloride
CID 119882864
N-(furan-2-ylmethyl)-2-(2-methoxyethylamino)acetamide
CID 3229603
1-[[4-(2-methoxyethoxy)phenyl]methyl]-2-methyl-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]guanidine;hydroiodide
CID 111551841
2-methyl-N-[2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]ethyl]propanamide
CID 39436445
N-(furan-2-ylmethyl)-2-(2-methoxyethylamino)acetamide;oxalic acid
CID 175652948
1-(3-hydroxybutyl)-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]urea
CID 111507627

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride (CID 119782299) is 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride is COCCNCC(=O)NCc1coc(-c2ccccc2)n1.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride?
The InChIKey is RDQZSOOLHUMNJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3.ClH/c1-20-8-7-16-10-14(19)17-9-13-11-21-15(18-13)12-5-3-2-4-6-12;/h2-6,11,16H,7-10H2,1H3,(H,17,19);1H.
What are the key properties of 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride?
2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride has a molecular weight of 325.80 g/mol, XLogP of 1.62, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 119782299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).