5H-anthra[1,2-c]diazet-10-one

C14H8N2O — CID 175765488

IUPAC5H-anthra[1,2-c]diazet-10-one
SMILESO=C1c2ccccc2Cc2ccc3c(c21)N=N3
InChIInChI=1S/C14H8N2O/c17-14-10-4-2-1-3-8(10)7-9-5-6-11-13(12(9)14)16-15-11/h1-6H,7H2
InChIKeyUEJNXYRCUJSKFE-UHFFFAOYSA-N
MW220.23 g/mol
LogP3.55
Rot. Bonds

About 5H-anthra[1,2-c]diazet-10-one

5H-anthra[1,2-c]diazet-10-one (PubChem CID 175765488) has the molecular formula C14H8N2O and a molecular weight of 220.23 g/mol. Its IUPAC name is 5H-anthra[1,2-c]diazet-10-one.

Molecular Properties

Compound Name5H-anthra[1,2-c]diazet-10-one
PubChem CID175765488
Molecular FormulaC14H8N2O
Molecular Weight220.23 g/mol
Exact Mass220.06
IUPAC Name5H-anthra[1,2-c]diazet-10-one
SMILESO=C1c2ccccc2Cc2ccc3c(c21)N=N3
InChIInChI=1S/C14H8N2O/c17-14-10-4-2-1-3-8(10)7-9-5-6-11-13(12(9)14)16-15-11/h1-6H,7H2
InChIKeyUEJNXYRCUJSKFE-UHFFFAOYSA-N
XLogP3.55
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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1-(1H-pyrazol-5-yl)-10H-anthracen-9-one
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10H-anthracen-9-one;ethane;methanol
CID 90976205
1,2-diphenoxy-10H-anthracen-9-one
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5-[(12-oxo-7H-benzo[a]anthracen-5-yl)diazenyl]-7H-benzo[a]anthracen-12-one
CID 87529385
1-propan-2-yloxy-10H-anthracen-9-one
CID 22730975
2,3-ditert-butyl-10H-anthracen-9-one
CID 58769690
CID 89225791
CID 89225791
1,2,3,4-tetrahydroxy-10H-anthracen-9-one
CID 91457355
2,5-dideuterio-1-hydroxy-10H-anthracen-9-one
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9H-fluorene;methanesulfonic acid
CID 172770963

Frequently Asked Questions

What is the IUPAC name of 5H-anthra[1,2-c]diazet-10-one?
The IUPAC name of 5H-anthra[1,2-c]diazet-10-one (CID 175765488) is 5H-anthra[1,2-c]diazet-10-one.
What is the SMILES notation for 5H-anthra[1,2-c]diazet-10-one?
The canonical SMILES for 5H-anthra[1,2-c]diazet-10-one is O=C1c2ccccc2Cc2ccc3c(c21)N=N3.
What is the InChIKey of 5H-anthra[1,2-c]diazet-10-one?
The InChIKey is UEJNXYRCUJSKFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N2O/c17-14-10-4-2-1-3-8(10)7-9-5-6-11-13(12(9)14)16-15-11/h1-6H,7H2.
What are the key properties of 5H-anthra[1,2-c]diazet-10-one?
5H-anthra[1,2-c]diazet-10-one has a molecular weight of 220.23 g/mol, XLogP of 3.55, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-anthra[1,2-c]diazet-10-one is sourced from PubChem (CID 175765488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).