aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium

C10H14FmNO3- — CID 165115773

IUPACaminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium
SMILESC=C/C=C(\C=C)CCC(=O)O.N[C-]=O.[Fm]
InChIInChI=1S/C9H12O2.CH2NO.Fm/c1-3-5-8(4-2)6-7-9(10)11;2-1-3;/h3-5H,1-2,6-7H2,(H,10,11);(H2,2,3);/q;-1;/b8-5+;;
InChIKeyASISHNDFKYCDEL-RMZRELHQSA-N
MW453.23 g/mol
LogP1.16
Rot. Bonds5

About aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium

aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium (PubChem CID 165115773) has the molecular formula C10H14FmNO3- and a molecular weight of 453.23 g/mol. Its IUPAC name is aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium.

Molecular Properties

Compound Nameaminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium
PubChem CID165115773
Molecular FormulaC10H14FmNO3-
Molecular Weight453.23 g/mol
Exact Mass453.19
IUPAC Nameaminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium
SMILESC=C/C=C(\C=C)CCC(=O)O.N[C-]=O.[Fm]
InChIInChI=1S/C9H12O2.CH2NO.Fm/c1-3-5-8(4-2)6-7-9(10)11;2-1-3;/h3-5H,1-2,6-7H2,(H,10,11);(H2,2,3);/q;-1;/b8-5+;;
InChIKeyASISHNDFKYCDEL-RMZRELHQSA-N
XLogP1.16
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.23
LogP ≤ 51.16
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

(6Z)-6-ethenylnona-6,8-dienoic acid;formic acid
CID 176918699
(4Z)-4-ethenylhepta-4,6-dienoyl chloride
CID 143083142
(4Z,6Z)-4-ethenylnona-4,6-dienoic acid
CID 176673158
3-(2-ethenylpenta-2,4-dienylsulfanyl)propanoic acid
CID 123311297
ethane;ethene;(Z)-4-ethenylhex-4-enoic acid
CID 177225786
[(3Z)-3-ethenylhexa-3,5-dienyl]carbamic acid;yttrium
CID 154661209
(3Z)-4-ethenyl-7-fluorohepta-1,3-diene
CID 143712076
2-amino-4-[(5Z)-5-ethenylocta-5,7-dienyl]sulfanylbutanoic acid
CID 170770358
acetic acid;butanedioic acid;prop-2-enoic acid
CID 161289385
N-[(3Z)-3-ethenylhexa-3,5-dienyl]formamide
CID 156731692
ethane;(2E)-2-ethenylpenta-2,4-dien-1-amine;molecular hydrogen
CID 144901462
(4Z)-4-ethenyl-1-phenylhepta-4,6-dien-1-ol
CID 142924342

Frequently Asked Questions

What is the IUPAC name of aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium?
The IUPAC name of aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium (CID 165115773) is aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium.
What is the SMILES notation for aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium?
The canonical SMILES for aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium is C=C/C=C(\C=C)CCC(=O)O.N[C-]=O.[Fm].
What is the InChIKey of aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium?
The InChIKey is ASISHNDFKYCDEL-RMZRELHQSA-N. The full InChI is InChI=1S/C9H12O2.CH2NO.Fm/c1-3-5-8(4-2)6-7-9(10)11;2-1-3;/h3-5H,1-2,6-7H2,(H,10,11);(H2,2,3);/q;-1;/b8-5+;;.
What are the key properties of aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium?
aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium has a molecular weight of 453.23 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for aminomethanone;(4Z)-4-ethenylhepta-4,6-dienoic acid;fermium is sourced from PubChem (CID 165115773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).