N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium

C10H17NO2U2 — CID 59954524

IUPACN-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium
SMILESCC(=O)NC1C(O)C=C(C)C[C@@H]1C.[U].[U]
InChIInChI=1S/C10H17NO2.2U/c1-6-4-7(2)10(9(13)5-6)11-8(3)12;;/h5,7,9-10,13H,4H2,1-3H3,(H,11,12);;/t7-,9?,10?;;/m0../s1
InChIKeyOJQJAXJRKXCUOQ-YNBYCUSSSA-N
MW659.31 g/mol
LogP0.84
Rot. Bonds1

About N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium

N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium (PubChem CID 59954524) has the molecular formula C10H17NO2U2 and a molecular weight of 659.31 g/mol. Its IUPAC name is N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium.

Molecular Properties

Compound NameN-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium
PubChem CID59954524
Molecular FormulaC10H17NO2U2
Molecular Weight659.31 g/mol
Exact Mass659.23
IUPAC NameN-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium
SMILESCC(=O)NC1C(O)C=C(C)C[C@@H]1C.[U].[U]
InChIInChI=1S/C10H17NO2.2U/c1-6-4-7(2)10(9(13)5-6)11-8(3)12;;/h5,7,9-10,13H,4H2,1-3H3,(H,11,12);;/t7-,9?,10?;;/m0../s1
InChIKeyOJQJAXJRKXCUOQ-YNBYCUSSSA-N
XLogP0.84
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500659.31
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium?
The IUPAC name of N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium (CID 59954524) is N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium.
What is the SMILES notation for N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium?
The canonical SMILES for N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium is CC(=O)NC1C(O)C=C(C)C[C@@H]1C.[U].[U].
What is the InChIKey of N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium?
The InChIKey is OJQJAXJRKXCUOQ-YNBYCUSSSA-N. The full InChI is InChI=1S/C10H17NO2.2U/c1-6-4-7(2)10(9(13)5-6)11-8(3)12;;/h5,7,9-10,13H,4H2,1-3H3,(H,11,12);;/t7-,9?,10?;;/m0../s1.
What are the key properties of N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium?
N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium has a molecular weight of 659.31 g/mol, XLogP of 0.84, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide;uranium is sourced from PubChem (CID 59954524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).