carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)

C11H20O2U — CID 163597799

IUPACcarbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)
SMILES[CH2-]C1C(C)C2C(OC)C2C1OC.[CH3-].[U+2]
InChIInChI=1S/C10H17O2.CH3.U/c1-5-6(2)9(11-3)8-7(5)10(8)12-4;;/h5-10H,2H2,1,3-4H3;1H3;/q2*-1;+2
InChIKeyRQNMYVAKUNXKJF-UHFFFAOYSA-N
MW422.31 g/mol
LogP1.81
Rot. Bonds2

About carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)

carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+) (PubChem CID 163597799) has the molecular formula C11H20O2U and a molecular weight of 422.31 g/mol. Its IUPAC name is carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+).

Molecular Properties

Compound Namecarbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)
PubChem CID163597799
Molecular FormulaC11H20O2U
Molecular Weight422.31 g/mol
Exact Mass422.20
IUPAC Namecarbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)
SMILES[CH2-]C1C(C)C2C(OC)C2C1OC.[CH3-].[U+2]
InChIInChI=1S/C10H17O2.CH3.U/c1-5-6(2)9(11-3)8-7(5)10(8)12-4;;/h5-10H,2H2,1,3-4H3;1H3;/q2*-1;+2
InChIKeyRQNMYVAKUNXKJF-UHFFFAOYSA-N
XLogP1.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.31
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+) with MolForge

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Related Compounds

2-(1-hydroxyethyl)-3,5-dimethoxy-4-methylcyclopentan-1-ol
CID 163417097
carbanide;iridium tetrahydride;1,2,3,4,5-pentamethylcyclopentane
CID 162298825
8-methoxy-2,5-dioxatricyclo[4.3.0.07,9]nonane
CID 163552350
(3S)-3,4,5-trimethoxy-2,6-dimethyloxane
CID 129044476
8-methoxy-4,9-dimethyltricyclo[5.2.1.02,6]decane
CID 71411324
cis-(1R,2S)-2,4-dimethoxy-3,5-dimethylcycloheptan-1-ol
CID 130360949
1-ethyl-3-methoxy-2,4-dimethylcyclopentane
CID 123552020
3-methoxy-4,5,6-trimethyloxan-2-ol
CID 58298710
trans-(1S,2S)-1-methoxy-2-methylcyclopropane
CID 176834458
(1S,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
CID 7020271
(1R,2S,4R,5R,7S,9S)-8-methoxytetracyclo[7.1.0.02,4.05,7]decane
CID 98557846
1,2,3,4-tetrachloro-5,6-dimethoxycyclohexane
CID 23273972

Frequently Asked Questions

What is the IUPAC name of carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)?
The IUPAC name of carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+) (CID 163597799) is carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+).
What is the SMILES notation for carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)?
The canonical SMILES for carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+) is [CH2-]C1C(C)C2C(OC)C2C1OC.[CH3-].[U+2].
What is the InChIKey of carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)?
The InChIKey is RQNMYVAKUNXKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17O2.CH3.U/c1-5-6(2)9(11-3)8-7(5)10(8)12-4;;/h5-10H,2H2,1,3-4H3;1H3;/q2*-1;+2.
What are the key properties of carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+)?
carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+) has a molecular weight of 422.31 g/mol, XLogP of 1.81, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;(4R,6S)-3-methanidyl-2,6-dimethoxy-4-methylbicyclo[3.1.0]hexane;uranium(2+) is sourced from PubChem (CID 163597799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).