6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]

C28H25N — CID 130462116

IUPAC6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]
SMILESCCc1ccc2c(c1)N(C)C1=C(CCC=C1)C21c2ccccc2-c2ccccc21
InChIInChI=1S/C28H25N/c1-3-19-16-17-25-27(18-19)29(2)26-15-9-8-14-24(26)28(25)22-12-6-4-10-20(22)21-11-5-7-13-23(21)28/h4-7,9-13,15-18H,3,8,14H2,1-2H3
InChIKeyLOGMYOZNVACYDD-UHFFFAOYSA-N
MW375.52 g/mol
LogP6.62
Rot. Bonds1

About 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]

6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene] (PubChem CID 130462116) has the molecular formula C28H25N and a molecular weight of 375.52 g/mol. Its IUPAC name is 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene].

Molecular Properties

Compound Name6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]
PubChem CID130462116
Molecular FormulaC28H25N
Molecular Weight375.52 g/mol
Exact Mass375.20
IUPAC Name6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]
SMILESCCc1ccc2c(c1)N(C)C1=C(CCC=C1)C21c2ccccc2-c2ccccc21
InChIInChI=1S/C28H25N/c1-3-19-16-17-25-27(18-19)29(2)26-15-9-8-14-24(26)28(25)22-12-6-4-10-20(22)21-11-5-7-13-23(21)28/h4-7,9-13,15-18H,3,8,14H2,1-2H3
InChIKeyLOGMYOZNVACYDD-UHFFFAOYSA-N
XLogP6.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.52
LogP ≤ 56.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]?
The IUPAC name of 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene] (CID 130462116) is 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene].
What is the SMILES notation for 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]?
The canonical SMILES for 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene] is CCc1ccc2c(c1)N(C)C1=C(CCC=C1)C21c2ccccc2-c2ccccc21.
What is the InChIKey of 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]?
The InChIKey is LOGMYOZNVACYDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25N/c1-3-19-16-17-25-27(18-19)29(2)26-15-9-8-14-24(26)28(25)22-12-6-4-10-20(22)21-11-5-7-13-23(21)28/h4-7,9-13,15-18H,3,8,14H2,1-2H3.
What are the key properties of 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene]?
6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene] has a molecular weight of 375.52 g/mol, XLogP of 6.62, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-10-methylspiro[1,2-dihydroacridine-9,9'-fluorene] is sourced from PubChem (CID 130462116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).