N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)

C17H34N2O2U — CID 169243785

IUPACN'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)
SMILESCOC.COCCCNCCNCc1ccccc1.[CH3-].[CH3-].[U+2]
InChIInChI=1S/C13H22N2O.C2H6O.2CH3.U/c1-16-11-5-8-14-9-10-15-12-13-6-3-2-4-7-13;1-3-2;;;/h2-4,6-7,14-15H,5,8-12H2,1H3;1-2H3;2*1H3;/q;;2*-1;+2
InChIKeyGOVVPQGSEVAZAW-UHFFFAOYSA-N
MW536.50 g/mol
LogP2.57
Rot. Bonds9

About N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)

N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+) (PubChem CID 169243785) has the molecular formula C17H34N2O2U and a molecular weight of 536.50 g/mol. Its IUPAC name is N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+).

Molecular Properties

Compound NameN'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)
PubChem CID169243785
Molecular FormulaC17H34N2O2U
Molecular Weight536.50 g/mol
Exact Mass536.31
IUPAC NameN'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)
SMILESCOC.COCCCNCCNCc1ccccc1.[CH3-].[CH3-].[U+2]
InChIInChI=1S/C13H22N2O.C2H6O.2CH3.U/c1-16-11-5-8-14-9-10-15-12-13-6-3-2-4-7-13;1-3-2;;;/h2-4,6-7,14-15H,5,8-12H2,1H3;1-2H3;2*1H3;/q;;2*-1;+2
InChIKeyGOVVPQGSEVAZAW-UHFFFAOYSA-N
XLogP2.57
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500536.50
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+) with MolForge

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Related Compounds

N-(3-methoxypropyl)-3-phenylpropan-1-amine
CID 28674385
N-benzyl-2-methoxyethanamine;fluoromethane
CID 176962791
N-(3-methoxypropyl)-N'-phenylethane-1,2-diamine
CID 54806182
N-benzyl-3-phenoxypropan-1-amine
CID 13291924
N-[(4-chlorophenyl)methyl]-3-methoxypropan-1-amine;hydrochloride
CID 17206437
N-benzyl-3-ethenoxypropan-1-amine
CID 43183138
1-benzyl-3-(3-methoxypropyl)thiourea
CID 19649292
N,N'-bis[5-(benzylamino)pentyl]hexane-1,6-diamine;tetrahydrochloride
CID 72715173
4-[(3-methoxypropylamino)methyl]-N,N-dimethylaniline;dihydrochloride
CID 17207022
N,N'-dibenzylhexane-1,6-diamine;dihydrobromide
CID 131880779
N-(2-aminoethyl)-N'-[2-(benzylamino)ethyl]propane-1,3-diamine;tetrahydrochloride
CID 11440858
N-(2-aminoethyl)-N'-[2-(benzylamino)ethyl]octane-1,8-diamine
CID 67649302

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)?
The IUPAC name of N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+) (CID 169243785) is N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+).
What is the SMILES notation for N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)?
The canonical SMILES for N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+) is COC.COCCCNCCNCc1ccccc1.[CH3-].[CH3-].[U+2].
What is the InChIKey of N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)?
The InChIKey is GOVVPQGSEVAZAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O.C2H6O.2CH3.U/c1-16-11-5-8-14-9-10-15-12-13-6-3-2-4-7-13;1-3-2;;;/h2-4,6-7,14-15H,5,8-12H2,1H3;1-2H3;2*1H3;/q;;2*-1;+2.
What are the key properties of N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)?
N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+) has a molecular weight of 536.50 g/mol, XLogP of 2.57, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+) is sourced from PubChem (CID 169243785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).