8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine

C17H20N4O — CID 58467215

IUPAC8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine
SMILESCc1noc(C)c1-c1cccc2c1CCC1(CN=C(N)N1)C2
InChIInChI=1S/C17H20N4O/c1-10-15(11(2)22-21-10)14-5-3-4-12-8-17(7-6-13(12)14)9-19-16(18)20-17/h3-5H,6-9H2,1-2H3,(H3,18,19,20)
InChIKeyKNZXACQOJSUAGY-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.10
Rot. Bonds1

About 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine

8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine (PubChem CID 58467215) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine.

Molecular Properties

Compound Name8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine
PubChem CID58467215
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine
SMILESCc1noc(C)c1-c1cccc2c1CCC1(CN=C(N)N1)C2
InChIInChI=1S/C17H20N4O/c1-10-15(11(2)22-21-10)14-5-3-4-12-8-17(7-6-13(12)14)9-19-16(18)20-17/h3-5H,6-9H2,1-2H3,(H3,18,19,20)
InChIKeyKNZXACQOJSUAGY-UHFFFAOYSA-N
XLogP2.10
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine?
The IUPAC name of 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine (CID 58467215) is 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine.
What is the SMILES notation for 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine?
The canonical SMILES for 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine is Cc1noc(C)c1-c1cccc2c1CCC1(CN=C(N)N1)C2.
What is the InChIKey of 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine?
The InChIKey is KNZXACQOJSUAGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-10-15(11(2)22-21-10)14-5-3-4-12-8-17(7-6-13(12)14)9-19-16(18)20-17/h3-5H,6-9H2,1-2H3,(H3,18,19,20).
What are the key properties of 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine?
8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine has a molecular weight of 296.37 g/mol, XLogP of 2.10, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8'-(3,5-dimethyl-1,2-oxazol-4-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine is sourced from PubChem (CID 58467215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).