2-methyl-3-oxodec-8-enamide

C11H19NO2 — CID 172994116

IUPAC2-methyl-3-oxodec-8-enamide
SMILESCC=CCCCCC(=O)C(C)C(N)=O
InChIInChI=1S/C11H19NO2/c1-3-4-5-6-7-8-10(13)9(2)11(12)14/h3-4,9H,5-8H2,1-2H3,(H2,12,14)
InChIKeyYWOSPVYOBUEGTL-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.81
Rot. Bonds7

About 2-methyl-3-oxodec-8-enamide

2-methyl-3-oxodec-8-enamide (PubChem CID 172994116) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-methyl-3-oxodec-8-enamide.

Molecular Properties

Compound Name2-methyl-3-oxodec-8-enamide
PubChem CID172994116
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name2-methyl-3-oxodec-8-enamide
SMILESCC=CCCCCC(=O)C(C)C(N)=O
InChIInChI=1S/C11H19NO2/c1-3-4-5-6-7-8-10(13)9(2)11(12)14/h3-4,9H,5-8H2,1-2H3,(H2,12,14)
InChIKeyYWOSPVYOBUEGTL-UHFFFAOYSA-N
XLogP1.81
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(Z)-non-7-enamide
CID 5365368
2-methylnon-7-enamide
CID 142782091
2-methyl-3-oxooctadecanamide
CID 141179225
(E)-2-methylnon-7-en-3-one
CID 88707157
(E)-hept-5-enamide
CID 18415105
(2Z,19Z)-henicosa-2,19-dien-11-one
CID 170029762
(E)-2-methyldodec-8-en-3-one
CID 176585053
(E)-2-methylnon-7-enoic acid
CID 146276957
(E)-2-methyl-3-propylnon-7-enamide;hydrochloride
CID 87894374
(2-hydroxy-3-undec-9-enoyloxypropyl) undec-9-enoate
CID 146171532
(E)-undec-9-en-3-one
CID 22074109
[(E)-pent-3-enyl] (E)-undec-9-enoate
CID 155355570

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-oxodec-8-enamide?
The IUPAC name of 2-methyl-3-oxodec-8-enamide (CID 172994116) is 2-methyl-3-oxodec-8-enamide.
What is the SMILES notation for 2-methyl-3-oxodec-8-enamide?
The canonical SMILES for 2-methyl-3-oxodec-8-enamide is CC=CCCCCC(=O)C(C)C(N)=O.
What is the InChIKey of 2-methyl-3-oxodec-8-enamide?
The InChIKey is YWOSPVYOBUEGTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-3-4-5-6-7-8-10(13)9(2)11(12)14/h3-4,9H,5-8H2,1-2H3,(H2,12,14).
What are the key properties of 2-methyl-3-oxodec-8-enamide?
2-methyl-3-oxodec-8-enamide has a molecular weight of 197.28 g/mol, XLogP of 1.81, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-oxodec-8-enamide is sourced from PubChem (CID 172994116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).