N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine

C43H30N2 — CID 134309245

IUPACN,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine
SMILESc1ccc(N(c2ccccc2)c2cccc3c2-c2ccccc2C32c3ccccc3N(c3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C43H30N2/c1-4-17-31(18-5-1)44(32-19-6-2-7-20-32)41-30-16-27-38-42(41)34-23-10-11-24-35(34)43(38)36-25-12-14-28-39(36)45(33-21-8-3-9-22-33)40-29-15-13-26-37(40)43/h1-30H
InChIKeyZNBCGBVQHGQMHQ-UHFFFAOYSA-N
MW574.73 g/mol
LogP11.30
Rot. Bonds4

About N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine

N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine (PubChem CID 134309245) has the molecular formula C43H30N2 and a molecular weight of 574.73 g/mol. Its IUPAC name is N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine.

Molecular Properties

Compound NameN,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine
PubChem CID134309245
Molecular FormulaC43H30N2
Molecular Weight574.73 g/mol
Exact Mass574.24
IUPAC NameN,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine
SMILESc1ccc(N(c2ccccc2)c2cccc3c2-c2ccccc2C32c3ccccc3N(c3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C43H30N2/c1-4-17-31(18-5-1)44(32-19-6-2-7-20-32)41-30-16-27-38-42(41)34-23-10-11-24-35(34)43(38)36-25-12-14-28-39(36)45(33-21-8-3-9-22-33)40-29-15-13-26-37(40)43/h1-30H
InChIKeyZNBCGBVQHGQMHQ-UHFFFAOYSA-N
XLogP11.30
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms45
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.73
LogP ≤ 511.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine?
The IUPAC name of N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine (CID 134309245) is N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine.
What is the SMILES notation for N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine?
The canonical SMILES for N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine is c1ccc(N(c2ccccc2)c2cccc3c2-c2ccccc2C32c3ccccc3N(c3ccccc3)c3ccccc32)cc1.
What is the InChIKey of N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine?
The InChIKey is ZNBCGBVQHGQMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30N2/c1-4-17-31(18-5-1)44(32-19-6-2-7-20-32)41-30-16-27-38-42(41)34-23-10-11-24-35(34)43(38)36-25-12-14-28-39(36)45(33-21-8-3-9-22-33)40-29-15-13-26-37(40)43/h1-30H.
What are the key properties of N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine?
N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine has a molecular weight of 574.73 g/mol, XLogP of 11.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine is sourced from PubChem (CID 134309245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).