1-(2-undecylimidazol-1-yl)ethanamine

C16H31N3 — CID 21242197

IUPAC1-(2-undecylimidazol-1-yl)ethanamine
SMILESCCCCCCCCCCCc1nccn1C(C)N
InChIInChI=1S/C16H31N3/c1-3-4-5-6-7-8-9-10-11-12-16-18-13-14-19(16)15(2)17/h13-15H,3-12,17H2,1-2H3
InChIKeyGWMWSTOWQNEAJH-UHFFFAOYSA-N
MW265.44 g/mol
LogP4.43
Rot. Bonds11

About 1-(2-undecylimidazol-1-yl)ethanamine

1-(2-undecylimidazol-1-yl)ethanamine (PubChem CID 21242197) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is 1-(2-undecylimidazol-1-yl)ethanamine.

Molecular Properties

Compound Name1-(2-undecylimidazol-1-yl)ethanamine
PubChem CID21242197
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC Name1-(2-undecylimidazol-1-yl)ethanamine
SMILESCCCCCCCCCCCc1nccn1C(C)N
InChIInChI=1S/C16H31N3/c1-3-4-5-6-7-8-9-10-11-12-16-18-13-14-19(16)15(2)17/h13-15H,3-12,17H2,1-2H3
InChIKeyGWMWSTOWQNEAJH-UHFFFAOYSA-N
XLogP4.43
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-undecylimidazol-1-amine
CID 19980062
2-(2-heptadecylimidazol-1-yl)butanedioic acid
CID 71319367
1-methyl-2-nonylimidazole
CID 67393993
1-bromo-2-heptylimidazole
CID 141436995
1-methyl-2-pentadecylimidazole
CID 68899434
6-[1-(2-undecylimidazol-1-yl)heptyl]-1,3,5-triazine-2,4-diamine
CID 175120563
(2-hexylimidazol-1-yl)methanamine
CID 141279127
1-(2-hexyl-4-methylimidazol-1-yl)ethanamine
CID 174643052
1,2-di(pentadecyl)imidazole
CID 69388452
alumane;2-hexyl-1-methylimidazole;tetrahydrochloride
CID 174887731
triethoxy-[3-(1-heptadecan-2-ylimidazol-2-yl)propyl]silane
CID 69233652
1-(1-octylimidazol-2-yl)propan-2-amine
CID 63096350

Frequently Asked Questions

What is the IUPAC name of 1-(2-undecylimidazol-1-yl)ethanamine?
The IUPAC name of 1-(2-undecylimidazol-1-yl)ethanamine (CID 21242197) is 1-(2-undecylimidazol-1-yl)ethanamine.
What is the SMILES notation for 1-(2-undecylimidazol-1-yl)ethanamine?
The canonical SMILES for 1-(2-undecylimidazol-1-yl)ethanamine is CCCCCCCCCCCc1nccn1C(C)N.
What is the InChIKey of 1-(2-undecylimidazol-1-yl)ethanamine?
The InChIKey is GWMWSTOWQNEAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-3-4-5-6-7-8-9-10-11-12-16-18-13-14-19(16)15(2)17/h13-15H,3-12,17H2,1-2H3.
What are the key properties of 1-(2-undecylimidazol-1-yl)ethanamine?
1-(2-undecylimidazol-1-yl)ethanamine has a molecular weight of 265.44 g/mol, XLogP of 4.43, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-undecylimidazol-1-yl)ethanamine is sourced from PubChem (CID 21242197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).