5-amino-N-dodecylpentanamide;hydrochloride

C17H37ClN2O — CID 135363918

IUPAC5-amino-N-dodecylpentanamide;hydrochloride
SMILESCCCCCCCCCCCCNC(=O)CCCCN.Cl
InChIInChI=1S/C17H36N2O.ClH/c1-2-3-4-5-6-7-8-9-10-13-16-19-17(20)14-11-12-15-18;/h2-16,18H2,1H3,(H,19,20);1H
InChIKeyUSQJRJPTTZLCDF-UHFFFAOYSA-N
MW320.95 g/mol
LogP4.57
Rot. Bonds15

About 5-amino-N-dodecylpentanamide;hydrochloride

5-amino-N-dodecylpentanamide;hydrochloride (PubChem CID 135363918) has the molecular formula C17H37ClN2O and a molecular weight of 320.95 g/mol. Its IUPAC name is 5-amino-N-dodecylpentanamide;hydrochloride.

Molecular Properties

Compound Name5-amino-N-dodecylpentanamide;hydrochloride
PubChem CID135363918
Molecular FormulaC17H37ClN2O
Molecular Weight320.95 g/mol
Exact Mass320.26
IUPAC Name5-amino-N-dodecylpentanamide;hydrochloride
SMILESCCCCCCCCCCCCNC(=O)CCCCN.Cl
InChIInChI=1S/C17H36N2O.ClH/c1-2-3-4-5-6-7-8-9-10-13-16-19-17(20)14-11-12-15-18;/h2-16,18H2,1H3,(H,19,20);1H
InChIKeyUSQJRJPTTZLCDF-UHFFFAOYSA-N
XLogP4.57
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.95
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-amino-N-dodecylpentanamide;hydrochloride 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-pentylhexanamide;hydrochloride
CID 51041459
N-(4-aminobutyl)tetracosanamide
CID 171117181
N-(6-aminohexyl)dodecanamide
CID 13030555
N-(9-aminononyl)nonanamide
CID 154091260
6-amino-N-butylhexanamide
CID 14914743
7-amino-N-butylheptanamide
CID 24689519
(Z)-N-(4-aminobutyl)pentadec-9-enamide
CID 171117158
N-[7-(dodecanoylamino)heptyl]dodecanamide
CID 4580774
N-[4-(heptanoylamino)butyl]heptanamide
CID 3363703
N-[6-(pentadecanoylamino)hexyl]pentadecanamide
CID 102117556
N-dodecylhexanamide
CID 3362981
N,N'-dihexadecyldecanediamide
CID 17080069

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-dodecylpentanamide;hydrochloride?
The IUPAC name of 5-amino-N-dodecylpentanamide;hydrochloride (CID 135363918) is 5-amino-N-dodecylpentanamide;hydrochloride.
What is the SMILES notation for 5-amino-N-dodecylpentanamide;hydrochloride?
The canonical SMILES for 5-amino-N-dodecylpentanamide;hydrochloride is CCCCCCCCCCCCNC(=O)CCCCN.Cl.
What is the InChIKey of 5-amino-N-dodecylpentanamide;hydrochloride?
The InChIKey is USQJRJPTTZLCDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O.ClH/c1-2-3-4-5-6-7-8-9-10-13-16-19-17(20)14-11-12-15-18;/h2-16,18H2,1H3,(H,19,20);1H.
What are the key properties of 5-amino-N-dodecylpentanamide;hydrochloride?
5-amino-N-dodecylpentanamide;hydrochloride has a molecular weight of 320.95 g/mol, XLogP of 4.57, 15 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-dodecylpentanamide;hydrochloride is sourced from PubChem (CID 135363918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).