N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide

C19H35NO3 — CID 165053172

IUPACN-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide
SMILESCCC(CCCC(C)C(=O)CO)C(=O)NC1CCCCCCC1
InChIInChI=1S/C19H35NO3/c1-3-16(11-9-10-15(2)18(22)14-21)19(23)20-17-12-7-5-4-6-8-13-17/h15-17,21H,3-14H2,1-2H3,(H,20,23)
InChIKeyPZKBUDNHXYZMPJ-UHFFFAOYSA-N
MW325.49 g/mol
LogP3.61
Rot. Bonds9

About N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide

N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide (PubChem CID 165053172) has the molecular formula C19H35NO3 and a molecular weight of 325.49 g/mol. Its IUPAC name is N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide.

Molecular Properties

Compound NameN-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide
PubChem CID165053172
Molecular FormulaC19H35NO3
Molecular Weight325.49 g/mol
Exact Mass325.26
IUPAC NameN-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide
SMILESCCC(CCCC(C)C(=O)CO)C(=O)NC1CCCCCCC1
InChIInChI=1S/C19H35NO3/c1-3-16(11-9-10-15(2)18(22)14-21)19(23)20-17-12-7-5-4-6-8-13-17/h15-17,21H,3-14H2,1-2H3,(H,20,23)
InChIKeyPZKBUDNHXYZMPJ-UHFFFAOYSA-N
XLogP3.61
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.49
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide?
The IUPAC name of N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide (CID 165053172) is N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide.
What is the SMILES notation for N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide?
The canonical SMILES for N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide is CCC(CCCC(C)C(=O)CO)C(=O)NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide?
The InChIKey is PZKBUDNHXYZMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NO3/c1-3-16(11-9-10-15(2)18(22)14-21)19(23)20-17-12-7-5-4-6-8-13-17/h15-17,21H,3-14H2,1-2H3,(H,20,23).
What are the key properties of N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide?
N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide has a molecular weight of 325.49 g/mol, XLogP of 3.61, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide is sourced from PubChem (CID 165053172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).