10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine

C34H30N4 — CID 59399718

IUPAC10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2N(c2cncc(N3c4ccccc4C(C)(C)c4ccccc43)n2)c2ccccc21
InChIInChI=1S/C34H30N4/c1-33(2)23-13-5-9-17-27(23)37(28-18-10-6-14-24(28)33)31-21-35-22-32(36-31)38-29-19-11-7-15-25(29)34(3,4)26-16-8-12-20-30(26)38/h5-22H,1-4H3
InChIKeyGWOJUESCCUFEQJ-UHFFFAOYSA-N
MW494.64 g/mol
LogP8.69
Rot. Bonds2

About 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine

10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine (PubChem CID 59399718) has the molecular formula C34H30N4 and a molecular weight of 494.64 g/mol. Its IUPAC name is 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine.

Molecular Properties

Compound Name10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine
PubChem CID59399718
Molecular FormulaC34H30N4
Molecular Weight494.64 g/mol
Exact Mass494.25
IUPAC Name10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2N(c2cncc(N3c4ccccc4C(C)(C)c4ccccc43)n2)c2ccccc21
InChIInChI=1S/C34H30N4/c1-33(2)23-13-5-9-17-27(23)37(28-18-10-6-14-24(28)33)31-21-35-22-32(36-31)38-29-19-11-7-15-25(29)34(3,4)26-16-8-12-20-30(26)38/h5-22H,1-4H3
InChIKeyGWOJUESCCUFEQJ-UHFFFAOYSA-N
XLogP8.69
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.64
LogP ≤ 58.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine?
The IUPAC name of 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine (CID 59399718) is 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine.
What is the SMILES notation for 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine?
The canonical SMILES for 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine is CC1(C)c2ccccc2N(c2cncc(N3c4ccccc4C(C)(C)c4ccccc43)n2)c2ccccc21.
What is the InChIKey of 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine?
The InChIKey is GWOJUESCCUFEQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H30N4/c1-33(2)23-13-5-9-17-27(23)37(28-18-10-6-14-24(28)33)31-21-35-22-32(36-31)38-29-19-11-7-15-25(29)34(3,4)26-16-8-12-20-30(26)38/h5-22H,1-4H3.
What are the key properties of 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine?
10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine has a molecular weight of 494.64 g/mol, XLogP of 8.69, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[6-(9,9-dimethylacridin-10-yl)pyrazin-2-yl]-9,9-dimethylacridine is sourced from PubChem (CID 59399718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).