8-hydroxy-7-methyl-N-propylnon-4-enamide

C13H25NO2 — CID 91382711

IUPAC8-hydroxy-7-methyl-N-propylnon-4-enamide
SMILESCCCNC(=O)CCC=CCC(C)C(C)O
InChIInChI=1S/C13H25NO2/c1-4-10-14-13(16)9-7-5-6-8-11(2)12(3)15/h5-6,11-12,15H,4,7-10H2,1-3H3,(H,14,16)
InChIKeyVNNYVCUJLHFWII-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.26
Rot. Bonds8

About 8-hydroxy-7-methyl-N-propylnon-4-enamide

8-hydroxy-7-methyl-N-propylnon-4-enamide (PubChem CID 91382711) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 8-hydroxy-7-methyl-N-propylnon-4-enamide.

Molecular Properties

Compound Name8-hydroxy-7-methyl-N-propylnon-4-enamide
PubChem CID91382711
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name8-hydroxy-7-methyl-N-propylnon-4-enamide
SMILESCCCNC(=O)CCC=CCC(C)C(C)O
InChIInChI=1S/C13H25NO2/c1-4-10-14-13(16)9-7-5-6-8-11(2)12(3)15/h5-6,11-12,15H,4,7-10H2,1-3H3,(H,14,16)
InChIKeyVNNYVCUJLHFWII-UHFFFAOYSA-N
XLogP2.26
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-hydroxy-4,4-dimethylpentyl)cyclohex-3-enecarboxamide
CID 71796915
(4Z,7Z,10Z,13Z,16Z,19Z)-N-(4-hydroxybutyl)docosa-4,7,10,13,16,19-hexaenamide
CID 90008891
6-hydroxy-N-propyloct-3-enamide
CID 58183383
N-(3-hydroxy-2,2-dimethylpropyl)cyclohex-3-ene-1-carboxamide
CID 81649464
(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
[3-Methyl-9-(propanoylamino)non-5-en-2-yl] acetate
CID 90796320
N-(8-hydroxy-7-methylnon-4-enyl)butanamide
CID 90893814
N-(8-hydroxy-7-methylnon-3-enyl)acetamide
CID 90930612
2-hydroxy-3-methyl-N-(6-methylhept-2-en-4-yl)butanamide
CID 90950606
N-(11-hydroxy-10-methyldodec-7-enyl)acetamide
CID 91355114

Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-7-methyl-N-propylnon-4-enamide?
The IUPAC name of 8-hydroxy-7-methyl-N-propylnon-4-enamide (CID 91382711) is 8-hydroxy-7-methyl-N-propylnon-4-enamide.
What is the SMILES notation for 8-hydroxy-7-methyl-N-propylnon-4-enamide?
The canonical SMILES for 8-hydroxy-7-methyl-N-propylnon-4-enamide is CCCNC(=O)CCC=CCC(C)C(C)O.
What is the InChIKey of 8-hydroxy-7-methyl-N-propylnon-4-enamide?
The InChIKey is VNNYVCUJLHFWII-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-4-10-14-13(16)9-7-5-6-8-11(2)12(3)15/h5-6,11-12,15H,4,7-10H2,1-3H3,(H,14,16).
What are the key properties of 8-hydroxy-7-methyl-N-propylnon-4-enamide?
8-hydroxy-7-methyl-N-propylnon-4-enamide has a molecular weight of 227.35 g/mol, XLogP of 2.26, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-7-methyl-N-propylnon-4-enamide is sourced from PubChem (CID 91382711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).