(2S)-2-methyl-3-oxodec-8-enamide

C11H19NO2 — CID 170990680

IUPAC(2S)-2-methyl-3-oxodec-8-enamide
SMILESCC=CCCCCC(=O)[C@H](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)/t9-/m0/s1
InChIKeyYWOSPVYOBUEGTL-VIFPVBQESA-N
MW197.28 g/mol
LogP1.81
Rot. Bonds7

About (2S)-2-methyl-3-oxodec-8-enamide

(2S)-2-methyl-3-oxodec-8-enamide (PubChem CID 170990680) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is (2S)-2-methyl-3-oxodec-8-enamide.

Molecular Properties

Compound Name(2S)-2-methyl-3-oxodec-8-enamide
PubChem CID170990680
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name(2S)-2-methyl-3-oxodec-8-enamide
SMILESCC=CCCCCC(=O)[C@H](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)/t9-/m0/s1
InChIKeyYWOSPVYOBUEGTL-VIFPVBQESA-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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Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-3-oxodec-8-enamide?
The IUPAC name of (2S)-2-methyl-3-oxodec-8-enamide (CID 170990680) is (2S)-2-methyl-3-oxodec-8-enamide.
What is the SMILES notation for (2S)-2-methyl-3-oxodec-8-enamide?
The canonical SMILES for (2S)-2-methyl-3-oxodec-8-enamide is CC=CCCCCC(=O)[C@H](C)C(N)=O.
What is the InChIKey of (2S)-2-methyl-3-oxodec-8-enamide?
The InChIKey is YWOSPVYOBUEGTL-VIFPVBQESA-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)/t9-/m0/s1.
What are the key properties of (2S)-2-methyl-3-oxodec-8-enamide?
(2S)-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 (2S)-2-methyl-3-oxodec-8-enamide is sourced from PubChem (CID 170990680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).