9-(10-methoxyanthracen-9-yl)acridine

C28H19NO — CID 102201153

IUPAC9-(10-methoxyanthracen-9-yl)acridine
SMILESCOc1c2ccccc2c(-c2c3ccccc3nc3ccccc23)c2ccccc12
InChIInChI=1S/C28H19NO/c1-30-28-20-12-4-2-10-18(20)26(19-11-3-5-13-21(19)28)27-22-14-6-8-16-24(22)29-25-17-9-7-15-23(25)27/h2-17H,1H3
InChIKeyCXWBSWARWIPHDL-UHFFFAOYSA-N
MW385.47 g/mol
LogP7.37
Rot. Bonds2

About 9-(10-methoxyanthracen-9-yl)acridine

9-(10-methoxyanthracen-9-yl)acridine (PubChem CID 102201153) has the molecular formula C28H19NO and a molecular weight of 385.47 g/mol. Its IUPAC name is 9-(10-methoxyanthracen-9-yl)acridine.

Molecular Properties

Compound Name9-(10-methoxyanthracen-9-yl)acridine
PubChem CID102201153
Molecular FormulaC28H19NO
Molecular Weight385.47 g/mol
Exact Mass385.15
IUPAC Name9-(10-methoxyanthracen-9-yl)acridine
SMILESCOc1c2ccccc2c(-c2c3ccccc3nc3ccccc23)c2ccccc12
InChIInChI=1S/C28H19NO/c1-30-28-20-12-4-2-10-18(20)26(19-11-3-5-13-21(19)28)27-22-14-6-8-16-24(22)29-25-17-9-7-15-23(25)27/h2-17H,1H3
InChIKeyCXWBSWARWIPHDL-UHFFFAOYSA-N
XLogP7.37
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.47
LogP ≤ 57.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

CID 99383
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CID 1481967
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CID 826247
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CID 44432660
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CID 44432680
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CID 91971313
CID 91971313
CID 118443998
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CID 1983598
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CID 68235
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CID 11483233
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CID 44432682
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CID 137646340
CID 137646340

Frequently Asked Questions

What is the IUPAC name of 9-(10-methoxyanthracen-9-yl)acridine?
The IUPAC name of 9-(10-methoxyanthracen-9-yl)acridine (CID 102201153) is 9-(10-methoxyanthracen-9-yl)acridine.
What is the SMILES notation for 9-(10-methoxyanthracen-9-yl)acridine?
The canonical SMILES for 9-(10-methoxyanthracen-9-yl)acridine is COc1c2ccccc2c(-c2c3ccccc3nc3ccccc23)c2ccccc12.
What is the InChIKey of 9-(10-methoxyanthracen-9-yl)acridine?
The InChIKey is CXWBSWARWIPHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H19NO/c1-30-28-20-12-4-2-10-18(20)26(19-11-3-5-13-21(19)28)27-22-14-6-8-16-24(22)29-25-17-9-7-15-23(25)27/h2-17H,1H3.
What are the key properties of 9-(10-methoxyanthracen-9-yl)acridine?
9-(10-methoxyanthracen-9-yl)acridine has a molecular weight of 385.47 g/mol, XLogP of 7.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(10-methoxyanthracen-9-yl)acridine is sourced from PubChem (CID 102201153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).