(E)-2-hydroxy-3-methyldec-5-en-4-one

C11H20O2 — CID 14297183

IUPAC(E)-2-hydroxy-3-methyldec-5-en-4-one
SMILESCCCC/C=C/C(=O)C(C)C(C)O
InChIInChI=1S/C11H20O2/c1-4-5-6-7-8-11(13)9(2)10(3)12/h7-10,12H,4-6H2,1-3H3/b8-7+
InChIKeyMFOFTCDEOPYNIG-BQYQJAHWSA-N
MW184.28 g/mol
LogP2.32
Rot. Bonds6

About (E)-2-hydroxy-3-methyldec-5-en-4-one

(E)-2-hydroxy-3-methyldec-5-en-4-one (PubChem CID 14297183) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is (E)-2-hydroxy-3-methyldec-5-en-4-one.

Molecular Properties

Compound Name(E)-2-hydroxy-3-methyldec-5-en-4-one
PubChem CID14297183
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name(E)-2-hydroxy-3-methyldec-5-en-4-one
SMILESCCCC/C=C/C(=O)C(C)C(C)O
InChIInChI=1S/C11H20O2/c1-4-5-6-7-8-11(13)9(2)10(3)12/h7-10,12H,4-6H2,1-3H3/b8-7+
InChIKeyMFOFTCDEOPYNIG-BQYQJAHWSA-N
XLogP2.32
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (E)-2-hydroxy-3-methyldec-5-en-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-7-hydroxy-2,2,8,8-tetramethylnon-3-en-5-one
CID 44410029
Lavendiol
CID 146684499
(E)-8-hydroxy-2,10-dimethylundec-4-en-6-one
CID 44410028
5-(Hydroxymethyl)-5-methylcyclopent-2-en-1-one
CID 90672018
(2E,6R)-6-hydroxyocta-2,7-dien-4-one
CID 162937710
Truncatenone
CID 170988528
(4S,5R)-4-hydroxy-5-methylcyclopent-2-en-1-one
CID 11829390
4-Hydroxy-5-methylcyclopent-2-en-1-one
CID 13037814
(4R,5S)-4-hydroxy-5-methylcyclopent-2-en-1-one
CID 58012716
6-Ethyl-7-hydroxy-4-octen-3-one
CID 581041
(4R,5S)-4-hydroxy-5-propan-2-ylcyclopent-2-en-1-one
CID 10441783
CID 11513879
CID 11513879

Frequently Asked Questions

What is the IUPAC name of (E)-2-hydroxy-3-methyldec-5-en-4-one?
The IUPAC name of (E)-2-hydroxy-3-methyldec-5-en-4-one (CID 14297183) is (E)-2-hydroxy-3-methyldec-5-en-4-one.
What is the SMILES notation for (E)-2-hydroxy-3-methyldec-5-en-4-one?
The canonical SMILES for (E)-2-hydroxy-3-methyldec-5-en-4-one is CCCC/C=C/C(=O)C(C)C(C)O.
What is the InChIKey of (E)-2-hydroxy-3-methyldec-5-en-4-one?
The InChIKey is MFOFTCDEOPYNIG-BQYQJAHWSA-N. The full InChI is InChI=1S/C11H20O2/c1-4-5-6-7-8-11(13)9(2)10(3)12/h7-10,12H,4-6H2,1-3H3/b8-7+.
What are the key properties of (E)-2-hydroxy-3-methyldec-5-en-4-one?
(E)-2-hydroxy-3-methyldec-5-en-4-one has a molecular weight of 184.28 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-hydroxy-3-methyldec-5-en-4-one is sourced from PubChem (CID 14297183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).