CID 87330016

C9H7BeNO — CID 87330016

IUPAC—
SMILESOc1cccc2cccnc12.[Be]
InChIInChI=1S/C9H7NO.Be/c11-8-5-1-3-7-4-2-6-10-9(7)8;/h1-6,11H;
InChIKeyLPZSCIKBNRTYMN-UHFFFAOYSA-N
MW154.17 g/mol
LogP1.56
Rot. Bonds

About CID 87330016

CID 87330016 (PubChem CID 87330016) has the molecular formula C9H7BeNO and a molecular weight of 154.17 g/mol.

Molecular Properties

Compound NameCID 87330016
PubChem CID87330016
Molecular FormulaC9H7BeNO
Molecular Weight154.17 g/mol
Exact Mass154.06
IUPAC Name—
SMILESOc1cccc2cccnc12.[Be]
InChIInChI=1S/C9H7NO.Be/c11-8-5-1-3-7-4-2-6-10-9(7)8;/h1-6,11H;
InChIKeyLPZSCIKBNRTYMN-UHFFFAOYSA-N
XLogP1.56
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 87330016?
The IUPAC name of CID 87330016 (CID 87330016) is not available.
What is the SMILES notation for CID 87330016?
The canonical SMILES for CID 87330016 is Oc1cccc2cccnc12.[Be].
What is the InChIKey of CID 87330016?
The InChIKey is LPZSCIKBNRTYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO.Be/c11-8-5-1-3-7-4-2-6-10-9(7)8;/h1-6,11H;.
What are the key properties of CID 87330016?
CID 87330016 has a molecular weight of 154.17 g/mol, XLogP of 1.56, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87330016 is sourced from PubChem (CID 87330016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).