N-[7-(pentanoylamino)heptyl]pentanamide

C17H34N2O2 — CID 4139658

IUPACN-[7-(pentanoylamino)heptyl]pentanamide
SMILESCCCCC(=O)NCCCCCCCNC(=O)CCCC
InChIInChI=1S/C17H34N2O2/c1-3-5-12-16(20)18-14-10-8-7-9-11-15-19-17(21)13-6-4-2/h3-15H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyMEPKGQJSOVSWCY-UHFFFAOYSA-N
MW298.47 g/mol
LogP3.55
Rot. Bonds14

About N-[7-(pentanoylamino)heptyl]pentanamide

N-[7-(pentanoylamino)heptyl]pentanamide (PubChem CID 4139658) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is N-[7-(pentanoylamino)heptyl]pentanamide.

Molecular Properties

Compound NameN-[7-(pentanoylamino)heptyl]pentanamide
PubChem CID4139658
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC NameN-[7-(pentanoylamino)heptyl]pentanamide
SMILESCCCCC(=O)NCCCCCCCNC(=O)CCCC
InChIInChI=1S/C17H34N2O2/c1-3-5-12-16(20)18-14-10-8-7-9-11-15-19-17(21)13-6-4-2/h3-15H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyMEPKGQJSOVSWCY-UHFFFAOYSA-N
XLogP3.55
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[7-(pentanoylamino)heptyl]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

N-tetradecylpentanamide
CID 87172595
N-[8-(heptanoylamino)octyl]heptanamide
CID 3252783
N-octadecyloctanamide
CID 5161729
N-[4-(heptanoylamino)butyl]heptanamide
CID 3363703
N-[6-(pentadecanoylamino)hexyl]pentadecanamide
CID 102117556
N-dodecylhexanamide
CID 3362981
N,N'-dihexadecyldecanediamide
CID 17080069
N'-heptyl-N-hexylpentanediamide
CID 154688669
N-[8-(dodecanoylamino)octyl]dodecanamide
CID 3273664
N-tetradecyloctanamide
CID 151737522
N-[6-(tricosanoylamino)hexyl]tricosanamide
CID 102117558
N-nonyltridecanamide
CID 154228217

Frequently Asked Questions

What is the IUPAC name of N-[7-(pentanoylamino)heptyl]pentanamide?
The IUPAC name of N-[7-(pentanoylamino)heptyl]pentanamide (CID 4139658) is N-[7-(pentanoylamino)heptyl]pentanamide.
What is the SMILES notation for N-[7-(pentanoylamino)heptyl]pentanamide?
The canonical SMILES for N-[7-(pentanoylamino)heptyl]pentanamide is CCCCC(=O)NCCCCCCCNC(=O)CCCC.
What is the InChIKey of N-[7-(pentanoylamino)heptyl]pentanamide?
The InChIKey is MEPKGQJSOVSWCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-3-5-12-16(20)18-14-10-8-7-9-11-15-19-17(21)13-6-4-2/h3-15H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-[7-(pentanoylamino)heptyl]pentanamide?
N-[7-(pentanoylamino)heptyl]pentanamide has a molecular weight of 298.47 g/mol, XLogP of 3.55, 14 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(pentanoylamino)heptyl]pentanamide is sourced from PubChem (CID 4139658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).