(5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide

C16H31NO2 — CID 71474838

IUPAC(5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide
SMILESC=CCN(C)C(=O)CCC[C@@H](C)C[C@@H](O)C(C)(C)C
InChIInChI=1S/C16H31NO2/c1-7-11-17(6)15(19)10-8-9-13(2)12-14(18)16(3,4)5/h7,13-14,18H,1,8-12H2,2-6H3/t13-,14-/m1/s1
InChIKeyUKJOGFLXEQPDEG-ZIAGYGMSSA-N
MW269.43 g/mol
LogP3.23
Rot. Bonds8

About (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide

(5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide (PubChem CID 71474838) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide.

Molecular Properties

Compound Name(5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide
PubChem CID71474838
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC Name(5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide
SMILESC=CCN(C)C(=O)CCC[C@@H](C)C[C@@H](O)C(C)(C)C
InChIInChI=1S/C16H31NO2/c1-7-11-17(6)15(19)10-8-9-13(2)12-14(18)16(3,4)5/h7,13-14,18H,1,8-12H2,2-6H3/t13-,14-/m1/s1
InChIKeyUKJOGFLXEQPDEG-ZIAGYGMSSA-N
XLogP3.23
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide 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

N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide
CID 10945964
(5R,7S)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide
CID 101909988
[3-Chloro-2-(2-hydroxypropyl)octadecanoyl]-dimethyl-prop-2-enylazanium
CID 174581099

Frequently Asked Questions

What is the IUPAC name of (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide?
The IUPAC name of (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide (CID 71474838) is (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide.
What is the SMILES notation for (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide?
The canonical SMILES for (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide is C=CCN(C)C(=O)CCC[C@@H](C)C[C@@H](O)C(C)(C)C.
What is the InChIKey of (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide?
The InChIKey is UKJOGFLXEQPDEG-ZIAGYGMSSA-N. The full InChI is InChI=1S/C16H31NO2/c1-7-11-17(6)15(19)10-8-9-13(2)12-14(18)16(3,4)5/h7,13-14,18H,1,8-12H2,2-6H3/t13-,14-/m1/s1.
What are the key properties of (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide?
(5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide has a molecular weight of 269.43 g/mol, XLogP of 3.23, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide is sourced from PubChem (CID 71474838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).