N-(11-hydroxy-10-methyldodec-7-enyl)acetamide

C15H29NO2 — CID 91355114

IUPACN-(11-hydroxy-10-methyldodec-7-enyl)acetamide
SMILESCC(=O)NCCCCCCC=CCC(C)C(C)O
InChIInChI=1S/C15H29NO2/c1-13(14(2)17)11-9-7-5-4-6-8-10-12-16-15(3)18/h7,9,13-14,17H,4-6,8,10-12H2,1-3H3,(H,16,18)
InChIKeyLNQZSGHLXTYSOJ-UHFFFAOYSA-N
MW255.40 g/mol
LogP3.04
Rot. Bonds10

About N-(11-hydroxy-10-methyldodec-7-enyl)acetamide

N-(11-hydroxy-10-methyldodec-7-enyl)acetamide (PubChem CID 91355114) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is N-(11-hydroxy-10-methyldodec-7-enyl)acetamide.

Molecular Properties

Compound NameN-(11-hydroxy-10-methyldodec-7-enyl)acetamide
PubChem CID91355114
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC NameN-(11-hydroxy-10-methyldodec-7-enyl)acetamide
SMILESCC(=O)NCCCCCCC=CCC(C)C(C)O
InChIInChI=1S/C15H29NO2/c1-13(14(2)17)11-9-7-5-4-6-8-10-12-16-15(3)18/h7,9,13-14,17H,4-6,8,10-12H2,1-3H3,(H,16,18)
InChIKeyLNQZSGHLXTYSOJ-UHFFFAOYSA-N
XLogP3.04
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 53.04
H-Bond Donors ≤ 52
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

N-(3-hydroxy-4,4-dimethylpentyl)cyclohex-3-enecarboxamide
CID 71796915
(E,7R,8S)-N-ethyl-8-hydroxy-7-methylnon-3-enamide
CID 88887571
N-[(E,7R,8S)-8-hydroxy-7-methylnon-3-enyl]acetamide
CID 88887575
N-ethyl-8-hydroxy-7-methylnon-3-enamide
CID 90783309
N-(8-hydroxy-7-methylnon-4-enyl)butanamide
CID 90893814
N-(8-hydroxy-7-methylnon-3-enyl)acetamide
CID 90930612
(12-Acetamido-3-methyldodec-5-en-2-yl) acetate
CID 91298865
8-hydroxy-7-methyl-N-propylnon-4-enamide
CID 91382711
(2S)-2-hydroxy-3-methyl-N-[(Z)-octadec-9-enyl]butanamide
CID 118244211
(2S)-2-hydroxy-3-methyl-N-octadec-9-enylbutanamide
CID 123542370
(7R,8S)-N-ethyl-8-hydroxy-7-methylnon-3-enamide
CID 123807803
N-[(Z)-1-hydroxy-2-methylhept-4-enyl]butanamide
CID 170069169

Frequently Asked Questions

What is the IUPAC name of N-(11-hydroxy-10-methyldodec-7-enyl)acetamide?
The IUPAC name of N-(11-hydroxy-10-methyldodec-7-enyl)acetamide (CID 91355114) is N-(11-hydroxy-10-methyldodec-7-enyl)acetamide.
What is the SMILES notation for N-(11-hydroxy-10-methyldodec-7-enyl)acetamide?
The canonical SMILES for N-(11-hydroxy-10-methyldodec-7-enyl)acetamide is CC(=O)NCCCCCCC=CCC(C)C(C)O.
What is the InChIKey of N-(11-hydroxy-10-methyldodec-7-enyl)acetamide?
The InChIKey is LNQZSGHLXTYSOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-13(14(2)17)11-9-7-5-4-6-8-10-12-16-15(3)18/h7,9,13-14,17H,4-6,8,10-12H2,1-3H3,(H,16,18).
What are the key properties of N-(11-hydroxy-10-methyldodec-7-enyl)acetamide?
N-(11-hydroxy-10-methyldodec-7-enyl)acetamide has a molecular weight of 255.40 g/mol, XLogP of 3.04, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(11-hydroxy-10-methyldodec-7-enyl)acetamide is sourced from PubChem (CID 91355114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).