10-hydroxy-N,N,9-trimethylundec-6-enamide

C14H27NO2 — CID 91063059

IUPAC10-hydroxy-N,N,9-trimethylundec-6-enamide
SMILESCC(O)C(C)CC=CCCCCC(=O)N(C)C
InChIInChI=1S/C14H27NO2/c1-12(13(2)16)10-8-6-5-7-9-11-14(17)15(3)4/h6,8,12-13,16H,5,7,9-11H2,1-4H3
InChIKeyAAHFTDGJDXPGIB-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.60
Rot. Bonds8

About 10-hydroxy-N,N,9-trimethylundec-6-enamide

10-hydroxy-N,N,9-trimethylundec-6-enamide (PubChem CID 91063059) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 10-hydroxy-N,N,9-trimethylundec-6-enamide.

Molecular Properties

Compound Name10-hydroxy-N,N,9-trimethylundec-6-enamide
PubChem CID91063059
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name10-hydroxy-N,N,9-trimethylundec-6-enamide
SMILESCC(O)C(C)CC=CCCCCC(=O)N(C)C
InChIInChI=1S/C14H27NO2/c1-12(13(2)16)10-8-6-5-7-9-11-14(17)15(3)4/h6,8,12-13,16H,5,7,9-11H2,1-4H3
InChIKeyAAHFTDGJDXPGIB-UHFFFAOYSA-N
XLogP2.60
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.60
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of 10-hydroxy-N,N,9-trimethylundec-6-enamide?
The IUPAC name of 10-hydroxy-N,N,9-trimethylundec-6-enamide (CID 91063059) is 10-hydroxy-N,N,9-trimethylundec-6-enamide.
What is the SMILES notation for 10-hydroxy-N,N,9-trimethylundec-6-enamide?
The canonical SMILES for 10-hydroxy-N,N,9-trimethylundec-6-enamide is CC(O)C(C)CC=CCCCCC(=O)N(C)C.
What is the InChIKey of 10-hydroxy-N,N,9-trimethylundec-6-enamide?
The InChIKey is AAHFTDGJDXPGIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-12(13(2)16)10-8-6-5-7-9-11-14(17)15(3)4/h6,8,12-13,16H,5,7,9-11H2,1-4H3.
What are the key properties of 10-hydroxy-N,N,9-trimethylundec-6-enamide?
10-hydroxy-N,N,9-trimethylundec-6-enamide has a molecular weight of 241.37 g/mol, XLogP of 2.60, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-hydroxy-N,N,9-trimethylundec-6-enamide is sourced from PubChem (CID 91063059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).