19-aminononadecyl(trimethyl)azanium

C22H49N2+ — CID 155769982

IUPAC19-aminononadecyl(trimethyl)azanium
SMILESC[N+](C)(C)CCCCCCCCCCCCCCCCCCCN
InChIInChI=1S/C22H49N2/c1-24(2,3)22-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21-23/h4-23H2,1-3H3/q+1
InChIKeyVJNYYLVEHLVKBD-UHFFFAOYSA-N
MW341.65 g/mol
LogP6.28
Rot. Bonds19

About 19-aminononadecyl(trimethyl)azanium

19-aminononadecyl(trimethyl)azanium (PubChem CID 155769982) has the molecular formula C22H49N2+ and a molecular weight of 341.65 g/mol. Its IUPAC name is 19-aminononadecyl(trimethyl)azanium.

Molecular Properties

Compound Name19-aminononadecyl(trimethyl)azanium
PubChem CID155769982
Molecular FormulaC22H49N2+
Molecular Weight341.65 g/mol
Exact Mass341.39
IUPAC Name19-aminononadecyl(trimethyl)azanium
SMILESC[N+](C)(C)CCCCCCCCCCCCCCCCCCCN
InChIInChI=1S/C22H49N2/c1-24(2,3)22-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21-23/h4-23H2,1-3H3/q+1
InChIKeyVJNYYLVEHLVKBD-UHFFFAOYSA-N
XLogP6.28
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.65
LogP ≤ 56.28
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
14-aminotetradecyl(trimethyl)azanium
CID 155769967
15-aminopentadecyl(trimethyl)azanium
CID 155769921
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 19-aminononadecyl(trimethyl)azanium?
The IUPAC name of 19-aminononadecyl(trimethyl)azanium (CID 155769982) is 19-aminononadecyl(trimethyl)azanium.
What is the SMILES notation for 19-aminononadecyl(trimethyl)azanium?
The canonical SMILES for 19-aminononadecyl(trimethyl)azanium is C[N+](C)(C)CCCCCCCCCCCCCCCCCCCN.
What is the InChIKey of 19-aminononadecyl(trimethyl)azanium?
The InChIKey is VJNYYLVEHLVKBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H49N2/c1-24(2,3)22-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21-23/h4-23H2,1-3H3/q+1.
What are the key properties of 19-aminononadecyl(trimethyl)azanium?
19-aminononadecyl(trimethyl)azanium has a molecular weight of 341.65 g/mol, XLogP of 6.28, 19 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 19-aminononadecyl(trimethyl)azanium is sourced from PubChem (CID 155769982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).