CID 134881879

C17H15N2Pd — CID 134881879

IUPAC—
SMILESN#Cc1ccccc1.N#Cc1ccccc1.[CH2]C=C.[Pd]
InChIInChI=1S/2C7H5N.C3H5.Pd/c2*8-6-7-4-2-1-3-5-7;1-3-2;/h2*1-5H;3H,1-2H2;
InChIKeyDKLJFHNBVRHIJA-UHFFFAOYSA-N
MW353.74 g/mol
LogP4.12
Rot. Bonds

About CID 134881879

CID 134881879 (PubChem CID 134881879) has the molecular formula C17H15N2Pd and a molecular weight of 353.74 g/mol.

Molecular Properties

Compound NameCID 134881879
PubChem CID134881879
Molecular FormulaC17H15N2Pd
Molecular Weight353.74 g/mol
Exact Mass353.03
IUPAC Name—
SMILESN#Cc1ccccc1.N#Cc1ccccc1.[CH2]C=C.[Pd]
InChIInChI=1S/2C7H5N.C3H5.Pd/c2*8-6-7-4-2-1-3-5-7;1-3-2;/h2*1-5H;3H,1-2H2;
InChIKeyDKLJFHNBVRHIJA-UHFFFAOYSA-N
XLogP4.12
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.74
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 134881879?
The IUPAC name of CID 134881879 (CID 134881879) is not available.
What is the SMILES notation for CID 134881879?
The canonical SMILES for CID 134881879 is N#Cc1ccccc1.N#Cc1ccccc1.[CH2]C=C.[Pd].
What is the InChIKey of CID 134881879?
The InChIKey is DKLJFHNBVRHIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H5N.C3H5.Pd/c2*8-6-7-4-2-1-3-5-7;1-3-2;/h2*1-5H;3H,1-2H2;.
What are the key properties of CID 134881879?
CID 134881879 has a molecular weight of 353.74 g/mol, XLogP of 4.12, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134881879 is sourced from PubChem (CID 134881879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).