5-amino-N-(11-oxododecyl)pentanamide

C17H34N2O2 — CID 171093439

IUPAC5-amino-N-(11-oxododecyl)pentanamide
SMILESCC(=O)CCCCCCCCCCNC(=O)CCCCN
InChIInChI=1S/C17H34N2O2/c1-16(20)12-8-6-4-2-3-5-7-11-15-19-17(21)13-9-10-14-18/h2-15,18H2,1H3,(H,19,21)
InChIKeyINEAIWODXYCMHH-UHFFFAOYSA-N
MW298.47 g/mol
LogP3.33
Rot. Bonds15

About 5-amino-N-(11-oxododecyl)pentanamide

5-amino-N-(11-oxododecyl)pentanamide (PubChem CID 171093439) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 5-amino-N-(11-oxododecyl)pentanamide.

Molecular Properties

Compound Name5-amino-N-(11-oxododecyl)pentanamide
PubChem CID171093439
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name5-amino-N-(11-oxododecyl)pentanamide
SMILESCC(=O)CCCCCCCCCCNC(=O)CCCCN
InChIInChI=1S/C17H34N2O2/c1-16(20)12-8-6-4-2-3-5-7-11-15-19-17(21)13-9-10-14-18/h2-15,18H2,1H3,(H,19,21)
InChIKeyINEAIWODXYCMHH-UHFFFAOYSA-N
XLogP3.33
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-amino-N-(11-oxododecyl)pentanamide 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

6-amino-N-(7-aminoheptyl)hexanamide
CID 56980494
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
N,N'-bis(7-aminoheptyl)pentanediamide
CID 86136288
N-(6-aminohexyl)dodecanamide
CID 13030555
5-amino-N-[5-(propanoylamino)pentyl]pentanamide
CID 170966361
N-(4-aminobutyl)tetracosanamide
CID 171117181
N-(9-aminononyl)nonanamide
CID 154091260
6-amino-N-(5-amino-5-oxopentyl)hexanamide
CID 106235898
13-amino-N-(6-aminohexyl)-6-oxotridecanamide
CID 157314658
6-(5-aminopentanoylamino)hexanoic acid;ethane
CID 144538701
5-amino-N-dodecylpentanamide;hydrochloride
CID 135363918
6-amino-N-pentylhexanamide;hydrochloride
CID 51041459

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(11-oxododecyl)pentanamide?
The IUPAC name of 5-amino-N-(11-oxododecyl)pentanamide (CID 171093439) is 5-amino-N-(11-oxododecyl)pentanamide.
What is the SMILES notation for 5-amino-N-(11-oxododecyl)pentanamide?
The canonical SMILES for 5-amino-N-(11-oxododecyl)pentanamide is CC(=O)CCCCCCCCCCNC(=O)CCCCN.
What is the InChIKey of 5-amino-N-(11-oxododecyl)pentanamide?
The InChIKey is INEAIWODXYCMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-16(20)12-8-6-4-2-3-5-7-11-15-19-17(21)13-9-10-14-18/h2-15,18H2,1H3,(H,19,21).
What are the key properties of 5-amino-N-(11-oxododecyl)pentanamide?
5-amino-N-(11-oxododecyl)pentanamide has a molecular weight of 298.47 g/mol, XLogP of 3.33, 15 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(11-oxododecyl)pentanamide is sourced from PubChem (CID 171093439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).