(E)-2-methoxyundec-6-enamide

C12H23NO2 — CID 143582513

IUPAC(E)-2-methoxyundec-6-enamide
SMILESCCCC/C=C/CCCC(OC)C(N)=O
InChIInChI=1S/C12H23NO2/c1-3-4-5-6-7-8-9-10-11(15-2)12(13)14/h6-7,11H,3-5,8-10H2,1-2H3,(H2,13,14)/b7-6+
InChIKeyBEVZOKQERYDTDT-VOTSOKGWSA-N
MW213.32 g/mol
LogP2.40
Rot. Bonds9

About (E)-2-methoxyundec-6-enamide

(E)-2-methoxyundec-6-enamide (PubChem CID 143582513) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is (E)-2-methoxyundec-6-enamide.

Molecular Properties

Compound Name(E)-2-methoxyundec-6-enamide
PubChem CID143582513
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name(E)-2-methoxyundec-6-enamide
SMILESCCCC/C=C/CCCC(OC)C(N)=O
InChIInChI=1S/C12H23NO2/c1-3-4-5-6-7-8-9-10-11(15-2)12(13)14/h6-7,11H,3-5,8-10H2,1-2H3,(H2,13,14)/b7-6+
InChIKeyBEVZOKQERYDTDT-VOTSOKGWSA-N
XLogP2.40
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl (Z)-2-methoxytetradec-6-enoate
CID 11065524
(Z)-2-methoxyoctadec-9-enoic acid
CID 46235517
1-acetyloxydec-5-enyl acetate
CID 86759751
ethyl 2-methoxyoctadeca-9,12,15-trienoate
CID 72538133
methyl (E)-2-aminododec-6-enoate
CID 175078394
methyl 2-methoxyheptanoate
CID 87952097
tetraethyl (E)-dec-5-ene-1,1,10,10-tetracarboxylate
CID 135011026
2-hexadecylicos-11-enamide
CID 173011844
[(Z)-octadec-9-enyl] 3-hydroxy-2-methoxypropanoate
CID 87759084
hept-2-enamide;dihydrochloride
CID 142841404
(E)-2-methyloctadec-9-enamide
CID 19371032
(Z)-2-aminooctadec-9-enamide
CID 56663673

Frequently Asked Questions

What is the IUPAC name of (E)-2-methoxyundec-6-enamide?
The IUPAC name of (E)-2-methoxyundec-6-enamide (CID 143582513) is (E)-2-methoxyundec-6-enamide.
What is the SMILES notation for (E)-2-methoxyundec-6-enamide?
The canonical SMILES for (E)-2-methoxyundec-6-enamide is CCCC/C=C/CCCC(OC)C(N)=O.
What is the InChIKey of (E)-2-methoxyundec-6-enamide?
The InChIKey is BEVZOKQERYDTDT-VOTSOKGWSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-4-5-6-7-8-9-10-11(15-2)12(13)14/h6-7,11H,3-5,8-10H2,1-2H3,(H2,13,14)/b7-6+.
What are the key properties of (E)-2-methoxyundec-6-enamide?
(E)-2-methoxyundec-6-enamide has a molecular weight of 213.32 g/mol, XLogP of 2.40, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-methoxyundec-6-enamide is sourced from PubChem (CID 143582513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).