CID 88747935

C15H22GeN2O4 — CID 88747935

IUPAC—
SMILESCN(C(=O)CCN1CCCCC1)c1ccc([Ge]OOO)cc1
InChIInChI=1S/C15H22GeN2O4/c1-17(14-7-5-13(6-8-14)16-21-22-20)15(19)9-12-18-10-3-2-4-11-18/h5-8,20H,2-4,9-12H2,1H3
InChIKeyNYEKJBTXBADINP-UHFFFAOYSA-N
MW366.96 g/mol
LogP1.19
Rot. Bonds7

About CID 88747935

CID 88747935 (PubChem CID 88747935) has the molecular formula C15H22GeN2O4 and a molecular weight of 366.96 g/mol.

Molecular Properties

Compound NameCID 88747935
PubChem CID88747935
Molecular FormulaC15H22GeN2O4
Molecular Weight366.96 g/mol
Exact Mass368.08
IUPAC Name—
SMILESCN(C(=O)CCN1CCCCC1)c1ccc([Ge]OOO)cc1
InChIInChI=1S/C15H22GeN2O4/c1-17(14-7-5-13(6-8-14)16-21-22-20)15(19)9-12-18-10-3-2-4-11-18/h5-8,20H,2-4,9-12H2,1H3
InChIKeyNYEKJBTXBADINP-UHFFFAOYSA-N
XLogP1.19
TPSA62.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.96
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

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3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-methyl-N-phenylpropanamide
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Frequently Asked Questions

What is the IUPAC name of CID 88747935?
The IUPAC name of CID 88747935 (CID 88747935) is not available.
What is the SMILES notation for CID 88747935?
The canonical SMILES for CID 88747935 is CN(C(=O)CCN1CCCCC1)c1ccc([Ge]OOO)cc1.
What is the InChIKey of CID 88747935?
The InChIKey is NYEKJBTXBADINP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22GeN2O4/c1-17(14-7-5-13(6-8-14)16-21-22-20)15(19)9-12-18-10-3-2-4-11-18/h5-8,20H,2-4,9-12H2,1H3.
What are the key properties of CID 88747935?
CID 88747935 has a molecular weight of 366.96 g/mol, XLogP of 1.19, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88747935 is sourced from PubChem (CID 88747935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).