5-((4-(4-Methylphenyl)piperazin-1-yl)methyl)-1,3-oxazolidin-2-imine

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Basic information

CAS: 144881-37-8
Standard SMILES: Cc1ccc(N2CCN(CC3CN=C(N)O3)CC2)cc1
InChIKey: XTEZFEOTYNRMGX-UHFFFAOYSA-N
Molecular formula: C15H22N4O
Average molar mass: 274.36 g/mol
Monoisotopic mass: 274.17936134

Names & identifiers

Preferred name: 5-((4-(4-Methylphenyl)piperazin-1-yl)methyl)-1,3-oxazolidin-2-imine
IUPAC: 5-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-4,5-dihydro-1,3-oxazol-2-amine
English name: Brn 5445196
Molecular formula: C15H22N4O
Molecular weight: 274.36138

Names & synonyms

144881-37-8DTXSID609324345-((4-(4-Methylphenyl)piperazin-1-yl)methyl)-1,3-oxazolidin-2-imine5-{[4-(4-Methylphenyl)piperazin-1-yl]methyl}-1,3-oxazolidin-2-imineRefChem:1072310DTXCID101361125BRN 54451964,5-Dihydro-5-((4-(4-methylphenyl)-1-piperazinyl)methyl)-2-oxazolamine2-Oxazolamine, 4,5-dihydro-5-((4-(4-methylphenyl)-1-piperazinyl)methyl)-BRN 54442942-Oxazolamine, 4,5-dihydro-5-((4-(3-methylphenyl)-1-piperazinyl)methyl)-5-{[4-(4-METHYLPHENYL)PIPERAZIN-1-YL]METHYL}-4,5-DIHYDRO-1,3-OXAZOL-2-AMINE

Database identifiers

CAS: 144881-37-8、144881-39-0
PubChem CID: 86251
DTXSID: DTXSID60932434

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 54.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 20
Formal charge: 0
Complexity: 344

Physicochemical properties

EWG's Food Scores: 1 · 1

Related reactions

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Compound notes

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