fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid

C11H16FmNO3- — CID 168915507

IUPACfermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid
SMILESC/C=C\C(=C/CC)CC(N[C-]=O)C(=O)O.[Fm]
InChIInChI=1S/C11H16NO3.Fm/c1-3-5-9(6-4-2)7-10(11(14)15)12-8-13;/h3,5-6,10H,4,7H2,1-2H3,(H,12,13)(H,14,15);/q-1;/b5-3-,9-6+;
InChIKeySUGOZJLYJLWDGB-XRVNEYCPSA-N
MW467.25 g/mol
LogP1.40
Rot. Bonds7

About fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid

fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid (PubChem CID 168915507) has the molecular formula C11H16FmNO3- and a molecular weight of 467.25 g/mol. Its IUPAC name is fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid.

Molecular Properties

Compound Namefermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid
PubChem CID168915507
Molecular FormulaC11H16FmNO3-
Molecular Weight467.25 g/mol
Exact Mass467.21
IUPAC Namefermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid
SMILESC/C=C\C(=C/CC)CC(N[C-]=O)C(=O)O.[Fm]
InChIInChI=1S/C11H16NO3.Fm/c1-3-5-9(6-4-2)7-10(11(14)15)12-8-13;/h3,5-6,10H,4,7H2,1-2H3,(H,12,13)(H,14,15);/q-1;/b5-3-,9-6+;
InChIKeySUGOZJLYJLWDGB-XRVNEYCPSA-N
XLogP1.40
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.25
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

fermium;(E)-3-hydroxy-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid
CID 168915673
(Z)-1-fluoro-3-[(Z)-prop-1-enyl]hex-3-en-1-ol
CID 129172048
(Z,4Z,7Z,8Z)-7,8-di(ethylidene)-6-methyl-4-propylideneundec-2-ene
CID 142130429
2-amino-4-ethylidenehept-5-enoic acid
CID 123282783
fermium;3-(3-methylphenyl)-2-(oxomethylamino)propanoic acid
CID 166481750
(E)-2-[(E)-prop-1-enyl]pent-2-enoic acid
CID 14178880
(2Z,4Z,6E)-4-ethyl-6-(2,2,2-trifluoroethyl)nona-2,4,6-triene
CID 178040675
(E)-N-ethyl-5-[(E)-prop-1-enyl]oct-5-en-1-amine
CID 134570205
[(E)-2-[(Z)-prop-1-enyl]pent-2-enyl] formate
CID 143198553
[(E)-2-[(Z)-prop-1-enyl]pent-2-enyl] N-propylcarbamate
CID 142103605
2-[[(E)-but-2-enoyl]amino]hexanoic acid
CID 43469928
(6Z)-3,6-diethylnona-4,6-dienoic acid
CID 143337059

Frequently Asked Questions

What is the IUPAC name of fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid?
The IUPAC name of fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid (CID 168915507) is fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid.
What is the SMILES notation for fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid?
The canonical SMILES for fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid is C/C=C\C(=C/CC)CC(N[C-]=O)C(=O)O.[Fm].
What is the InChIKey of fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid?
The InChIKey is SUGOZJLYJLWDGB-XRVNEYCPSA-N. The full InChI is InChI=1S/C11H16NO3.Fm/c1-3-5-9(6-4-2)7-10(11(14)15)12-8-13;/h3,5-6,10H,4,7H2,1-2H3,(H,12,13)(H,14,15);/q-1;/b5-3-,9-6+;.
What are the key properties of fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid?
fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid has a molecular weight of 467.25 g/mol, XLogP of 1.40, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fermium;(Z)-2-(oxomethylamino)-4-[(Z)-prop-1-enyl]hept-4-enoic acid is sourced from PubChem (CID 168915507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).