1-tributylgermylpyrrole-2,5-dione

C16H29GeNO2 — CID 16702640

IUPAC1-tributylgermylpyrrole-2,5-dione
SMILESCCCC[Ge](CCCC)(CCCC)N1C(=O)C=CC1=O
InChIInChI=1S/C16H29GeNO2/c1-4-7-12-17(13-8-5-2,14-9-6-3)18-15(19)10-11-16(18)20/h10-11H,4-9,12-14H2,1-3H3
InChIKeyJRLAGLSTJBJGSN-UHFFFAOYSA-N
MW340.02 g/mol
LogP4.26
Rot. Bonds10

About 1-tributylgermylpyrrole-2,5-dione

1-tributylgermylpyrrole-2,5-dione (PubChem CID 16702640) has the molecular formula C16H29GeNO2 and a molecular weight of 340.02 g/mol. Its IUPAC name is 1-tributylgermylpyrrole-2,5-dione.

Molecular Properties

Compound Name1-tributylgermylpyrrole-2,5-dione
PubChem CID16702640
Molecular FormulaC16H29GeNO2
Molecular Weight340.02 g/mol
Exact Mass341.14
IUPAC Name1-tributylgermylpyrrole-2,5-dione
SMILESCCCC[Ge](CCCC)(CCCC)N1C(=O)C=CC1=O
InChIInChI=1S/C16H29GeNO2/c1-4-7-12-17(13-8-5-2,14-9-6-3)18-15(19)10-11-16(18)20/h10-11H,4-9,12-14H2,1-3H3
InChIKeyJRLAGLSTJBJGSN-UHFFFAOYSA-N
XLogP4.26
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.02
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-tributylgermylpyrrole-2,5-dione?
The IUPAC name of 1-tributylgermylpyrrole-2,5-dione (CID 16702640) is 1-tributylgermylpyrrole-2,5-dione.
What is the SMILES notation for 1-tributylgermylpyrrole-2,5-dione?
The canonical SMILES for 1-tributylgermylpyrrole-2,5-dione is CCCC[Ge](CCCC)(CCCC)N1C(=O)C=CC1=O.
What is the InChIKey of 1-tributylgermylpyrrole-2,5-dione?
The InChIKey is JRLAGLSTJBJGSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29GeNO2/c1-4-7-12-17(13-8-5-2,14-9-6-3)18-15(19)10-11-16(18)20/h10-11H,4-9,12-14H2,1-3H3.
What are the key properties of 1-tributylgermylpyrrole-2,5-dione?
1-tributylgermylpyrrole-2,5-dione has a molecular weight of 340.02 g/mol, XLogP of 4.26, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tributylgermylpyrrole-2,5-dione is sourced from PubChem (CID 16702640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).