N-undecyltetradecan-1-amine

C25H53N — CID 166059375

IUPACN-undecyltetradecan-1-amine
SMILESCCCCCCCCCCCCCCNCCCCCCCCCCC
InChIInChI=1S/C25H53N/c1-3-5-7-9-11-13-14-15-17-19-21-23-25-26-24-22-20-18-16-12-10-8-6-4-2/h26H,3-25H2,1-2H3
InChIKeyXHNAZXHVCDKDNB-UHFFFAOYSA-N
MW367.71 g/mol
LogP8.81
Rot. Bonds23

About N-undecyltetradecan-1-amine

N-undecyltetradecan-1-amine (PubChem CID 166059375) has the molecular formula C25H53N and a molecular weight of 367.71 g/mol. Its IUPAC name is N-undecyltetradecan-1-amine.

Molecular Properties

Compound NameN-undecyltetradecan-1-amine
PubChem CID166059375
Molecular FormulaC25H53N
Molecular Weight367.71 g/mol
Exact Mass367.42
IUPAC NameN-undecyltetradecan-1-amine
SMILESCCCCCCCCCCCCCCNCCCCCCCCCCC
InChIInChI=1S/C25H53N/c1-3-5-7-9-11-13-14-15-17-19-21-23-25-26-24-22-20-18-16-12-10-8-6-4-2/h26H,3-25H2,1-2H3
InChIKeyXHNAZXHVCDKDNB-UHFFFAOYSA-N
XLogP8.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds23
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.71
LogP ≤ 58.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-hexyltridecan-1-amine
CID 87659278
octane;N-octylnonan-1-amine
CID 145152206
N,N'-diheptyldecane-1,10-diamine
CID 3028161
N,N'-diheptylhexane-1,6-diamine
CID 3028571
N-docosyldocosan-1-amine;hydrochloride
CID 173181498
N,N'-di(nonyl)ethane-1,2-diamine
CID 151189669
methane;N-octyloctan-1-amine
CID 87294693
N-butyltetradecan-1-amine
CID 3548872
N-hexylhexan-1-amine;hydrochloride
CID 519999
N-octylnonan-1-amine;hydrochloride
CID 90480847
sulfanium;N-decyldecan-1-amine;chloride
CID 158756952
azane;N-hexyldecan-1-amine;dihydroiodide
CID 173206397

Frequently Asked Questions

What is the IUPAC name of N-undecyltetradecan-1-amine?
The IUPAC name of N-undecyltetradecan-1-amine (CID 166059375) is N-undecyltetradecan-1-amine.
What is the SMILES notation for N-undecyltetradecan-1-amine?
The canonical SMILES for N-undecyltetradecan-1-amine is CCCCCCCCCCCCCCNCCCCCCCCCCC.
What is the InChIKey of N-undecyltetradecan-1-amine?
The InChIKey is XHNAZXHVCDKDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H53N/c1-3-5-7-9-11-13-14-15-17-19-21-23-25-26-24-22-20-18-16-12-10-8-6-4-2/h26H,3-25H2,1-2H3.
What are the key properties of N-undecyltetradecan-1-amine?
N-undecyltetradecan-1-amine has a molecular weight of 367.71 g/mol, XLogP of 8.81, 23 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-undecyltetradecan-1-amine is sourced from PubChem (CID 166059375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).