CID 159709187

C9H7MgN — CID 159709187

IUPAC—
SMILES[Mg].c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.Mg/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-7H;
InChIKeyMYPNFKKWGMMNMA-UHFFFAOYSA-N
MW153.47 g/mol
LogP1.85
Rot. Bonds

About CID 159709187

CID 159709187 (PubChem CID 159709187) has the molecular formula C9H7MgN and a molecular weight of 153.47 g/mol.

Molecular Properties

Compound NameCID 159709187
PubChem CID159709187
Molecular FormulaC9H7MgN
Molecular Weight153.47 g/mol
Exact Mass153.04
IUPAC Name—
SMILES[Mg].c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.Mg/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-7H;
InChIKeyMYPNFKKWGMMNMA-UHFFFAOYSA-N
XLogP1.85
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.47
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 159709187?
The IUPAC name of CID 159709187 (CID 159709187) is not available.
What is the SMILES notation for CID 159709187?
The canonical SMILES for CID 159709187 is [Mg].c1ccc2ncccc2c1.
What is the InChIKey of CID 159709187?
The InChIKey is MYPNFKKWGMMNMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N.Mg/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-7H;.
What are the key properties of CID 159709187?
CID 159709187 has a molecular weight of 153.47 g/mol, XLogP of 1.85, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159709187 is sourced from PubChem (CID 159709187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).