pentadecanediamide

C15H30N2O2 — CID 87429217

IUPACpentadecanediamide
SMILESNC(=O)CCCCCCCCCCCCCC(N)=O
InChIInChI=1S/C15H30N2O2/c16-14(18)12-10-8-6-4-2-1-3-5-7-9-11-13-15(17)19/h1-13H2,(H2,16,18)(H2,17,19)
InChIKeyLQLJOBJGDYWBMU-UHFFFAOYSA-N
MW270.42 g/mol
LogP3.03
Rot. Bonds14

About pentadecanediamide

pentadecanediamide (PubChem CID 87429217) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is pentadecanediamide.

Molecular Properties

Compound Namepentadecanediamide
PubChem CID87429217
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Namepentadecanediamide
SMILESNC(=O)CCCCCCCCCCCCCC(N)=O
InChIInChI=1S/C15H30N2O2/c16-14(18)12-10-8-6-4-2-1-3-5-7-9-11-13-15(17)19/h1-13H2,(H2,16,18)(H2,17,19)
InChIKeyLQLJOBJGDYWBMU-UHFFFAOYSA-N
XLogP3.03
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

docosanediamide;hexacosanediamide
CID 129179979
dodecanediamide;nonanediamide
CID 175017820
nonatetracontanediamide
CID 162734608
copper;tridecanediamide
CID 159780260
hexanediamide;hydrazine
CID 160978463
hexanediamide;hydrazine
CID 160854105
34-amino-34-oxotetratriacontanoic acid
CID 139682719
6-hydroxyhexanamide
CID 11815390
24-amino-24-oxotetracosanoic acid
CID 139682769
18-hydroxyoctadecanamide
CID 54261687
16-aminohexadecanamide
CID 86033165
cyclohexane;hexanediamide
CID 22340258

Frequently Asked Questions

What is the IUPAC name of pentadecanediamide?
The IUPAC name of pentadecanediamide (CID 87429217) is pentadecanediamide.
What is the SMILES notation for pentadecanediamide?
The canonical SMILES for pentadecanediamide is NC(=O)CCCCCCCCCCCCCC(N)=O.
What is the InChIKey of pentadecanediamide?
The InChIKey is LQLJOBJGDYWBMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c16-14(18)12-10-8-6-4-2-1-3-5-7-9-11-13-15(17)19/h1-13H2,(H2,16,18)(H2,17,19).
What are the key properties of pentadecanediamide?
pentadecanediamide has a molecular weight of 270.42 g/mol, XLogP of 3.03, 14 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pentadecanediamide is sourced from PubChem (CID 87429217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).