4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten

C10H17FNOW- — CID 154676681

IUPAC4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten
SMILESC=C(F)CCNC(=C)CCOC[CH2-].[W]
InChIInChI=1S/C10H17FNO.W/c1-4-13-8-6-10(3)12-7-5-9(2)11;/h12H,1-8H2;/q-1;
InChIKeyWDPTYLABSRZXPS-UHFFFAOYSA-N
MW370.09 g/mol
LogP2.20
Rot. Bonds8

About 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten

4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten (PubChem CID 154676681) has the molecular formula C10H17FNOW- and a molecular weight of 370.09 g/mol. Its IUPAC name is 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten.

Molecular Properties

Compound Name4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten
PubChem CID154676681
Molecular FormulaC10H17FNOW-
Molecular Weight370.09 g/mol
Exact Mass370.08
IUPAC Name4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten
SMILESC=C(F)CCNC(=C)CCOC[CH2-].[W]
InChIInChI=1S/C10H17FNO.W/c1-4-13-8-6-10(3)12-7-5-9(2)11;/h12H,1-8H2;/q-1;
InChIKeyWDPTYLABSRZXPS-UHFFFAOYSA-N
XLogP2.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.09
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 154676718
CID 154676718
3-ethoxy-N-(3-oxobutyl)propanamide;vanadium
CID 171817114
ethane;3-(3-ethoxypropanoylamino)-N-ethylpropanamide;molecular hydrogen;tungsten
CID 168962154
N-(4-ethoxybut-1-en-2-yl)-3-methylpentan-1-amine
CID 170597699
ethane;N'-(2-ethoxyethyl)-N-methylbutanediamide;molecular hydrogen;tungsten
CID 156649542
N-butylhept-1-en-2-amine
CID 170620308
1-fluoro-N-(methoxymethyl)ethenamine
CID 130438085
N-hexyloct-1-en-2-amine
CID 169110016
4-bromo-N-[2-(3-methylbut-3-enoxy)ethyl]aniline
CID 114470913
3-[2-[2-(carboxyamino)ethoxy]ethoxy]propanoic acid
CID 176555841
N-[[4-[2-(3-methylbut-3-enoxy)ethoxy]phenyl]methyl]propan-1-amine
CID 114470830
4-oxo-4-[2-(2-sulfanylethoxy)ethylamino]butanoyl fluoride
CID 154676723

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten?
The IUPAC name of 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten (CID 154676681) is 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten.
What is the SMILES notation for 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten?
The canonical SMILES for 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten is C=C(F)CCNC(=C)CCOC[CH2-].[W].
What is the InChIKey of 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten?
The InChIKey is WDPTYLABSRZXPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17FNO.W/c1-4-13-8-6-10(3)12-7-5-9(2)11;/h12H,1-8H2;/q-1;.
What are the key properties of 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten?
4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten has a molecular weight of 370.09 g/mol, XLogP of 2.20, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(3-fluorobut-3-enyl)but-1-en-2-amine;tungsten is sourced from PubChem (CID 154676681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).