5-ethyl-3-hydroxy-N,N-dimethylnonanamide

C13H27NO2 — CID 175454513

IUPAC5-ethyl-3-hydroxy-N,N-dimethylnonanamide
SMILESCCCCC(CC)CC(O)CC(=O)N(C)C
InChIInChI=1S/C13H27NO2/c1-5-7-8-11(6-2)9-12(15)10-13(16)14(3)4/h11-12,15H,5-10H2,1-4H3
InChIKeyVKZAEKBQIOEYGJ-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.43
Rot. Bonds8

About 5-ethyl-3-hydroxy-N,N-dimethylnonanamide

5-ethyl-3-hydroxy-N,N-dimethylnonanamide (PubChem CID 175454513) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 5-ethyl-3-hydroxy-N,N-dimethylnonanamide.

Molecular Properties

Compound Name5-ethyl-3-hydroxy-N,N-dimethylnonanamide
PubChem CID175454513
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name5-ethyl-3-hydroxy-N,N-dimethylnonanamide
SMILESCCCCC(CC)CC(O)CC(=O)N(C)C
InChIInChI=1S/C13H27NO2/c1-5-7-8-11(6-2)9-12(15)10-13(16)14(3)4/h11-12,15H,5-10H2,1-4H3
InChIKeyVKZAEKBQIOEYGJ-UHFFFAOYSA-N
XLogP2.43
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-hydroxy-N,N-dimethylnonanamide?
The IUPAC name of 5-ethyl-3-hydroxy-N,N-dimethylnonanamide (CID 175454513) is 5-ethyl-3-hydroxy-N,N-dimethylnonanamide.
What is the SMILES notation for 5-ethyl-3-hydroxy-N,N-dimethylnonanamide?
The canonical SMILES for 5-ethyl-3-hydroxy-N,N-dimethylnonanamide is CCCCC(CC)CC(O)CC(=O)N(C)C.
What is the InChIKey of 5-ethyl-3-hydroxy-N,N-dimethylnonanamide?
The InChIKey is VKZAEKBQIOEYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-5-7-8-11(6-2)9-12(15)10-13(16)14(3)4/h11-12,15H,5-10H2,1-4H3.
What are the key properties of 5-ethyl-3-hydroxy-N,N-dimethylnonanamide?
5-ethyl-3-hydroxy-N,N-dimethylnonanamide has a molecular weight of 229.36 g/mol, XLogP of 2.43, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-hydroxy-N,N-dimethylnonanamide is sourced from PubChem (CID 175454513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).