15-aminopentadecyl(trimethyl)azanium

C18H41N2+ — CID 155769921

IUPAC15-aminopentadecyl(trimethyl)azanium
SMILESC[N+](C)(C)CCCCCCCCCCCCCCCN
InChIInChI=1S/C18H41N2/c1-20(2,3)18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19/h4-19H2,1-3H3/q+1
InChIKeyRSNBAYASBPSBLC-UHFFFAOYSA-N
MW285.54 g/mol
LogP4.72
Rot. Bonds15

About 15-aminopentadecyl(trimethyl)azanium

15-aminopentadecyl(trimethyl)azanium (PubChem CID 155769921) has the molecular formula C18H41N2+ and a molecular weight of 285.54 g/mol. Its IUPAC name is 15-aminopentadecyl(trimethyl)azanium.

Molecular Properties

Compound Name15-aminopentadecyl(trimethyl)azanium
PubChem CID155769921
Molecular FormulaC18H41N2+
Molecular Weight285.54 g/mol
Exact Mass285.33
IUPAC Name15-aminopentadecyl(trimethyl)azanium
SMILESC[N+](C)(C)CCCCCCCCCCCCCCCN
InChIInChI=1S/C18H41N2/c1-20(2,3)18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19/h4-19H2,1-3H3/q+1
InChIKeyRSNBAYASBPSBLC-UHFFFAOYSA-N
XLogP4.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.54
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

17-aminoheptadecyl(trimethyl)azanium
CID 155769924
19-aminononadecyl(trimethyl)azanium
CID 155769982
14-aminotetradecyl(trimethyl)azanium
CID 155769967
12-aminododecyl(trimethyl)azanium;azane;hydrate
CID 174892223
3-aminopropyl(trimethyl)azanium;hydrochloride
CID 173485800
trimethyl-[20-(trimethylazaniumyl)icosyl]azanium
CID 10318705
trimethyl-[5-(trimethylazaniumyl)pentyl]azanium diiodide
CID 21353
tetrakis(trimethyl-[10-(trimethylazaniumyl)decyl]azanium);octaiodide
CID 173060606
trimethyl-[22-(trimethylazaniumyl)docosyl]azanium dichloride
CID 71335073
trimethyl-[10-(trimethylazaniumyl)decyl]azanium dibromide
CID 10921
aminomethyl-dimethyl-[6-(trimethylazaniumyl)hexyl]azanium
CID 173080790
trimethyl-[4-(trimethylazaniumyl)butyl]azanium dihydroxide
CID 12712148

Frequently Asked Questions

What is the IUPAC name of 15-aminopentadecyl(trimethyl)azanium?
The IUPAC name of 15-aminopentadecyl(trimethyl)azanium (CID 155769921) is 15-aminopentadecyl(trimethyl)azanium.
What is the SMILES notation for 15-aminopentadecyl(trimethyl)azanium?
The canonical SMILES for 15-aminopentadecyl(trimethyl)azanium is C[N+](C)(C)CCCCCCCCCCCCCCCN.
What is the InChIKey of 15-aminopentadecyl(trimethyl)azanium?
The InChIKey is RSNBAYASBPSBLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H41N2/c1-20(2,3)18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19/h4-19H2,1-3H3/q+1.
What are the key properties of 15-aminopentadecyl(trimethyl)azanium?
15-aminopentadecyl(trimethyl)azanium has a molecular weight of 285.54 g/mol, XLogP of 4.72, 15 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 15-aminopentadecyl(trimethyl)azanium is sourced from PubChem (CID 155769921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).