2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine

C15H33N3 — CID 57356330

IUPAC2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine
SMILESCCCCCCC(C)(C)C1N(C)CCN1CCN
InChIInChI=1S/C15H33N3/c1-5-6-7-8-9-15(2,3)14-17(4)12-13-18(14)11-10-16/h14H,5-13,16H2,1-4H3
InChIKeyGHLBYZJYGYTIRO-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.52
Rot. Bonds8

About 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine

2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine (PubChem CID 57356330) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine
PubChem CID57356330
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC Name2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine
SMILESCCCCCCC(C)(C)C1N(C)CCN1CCN
InChIInChI=1S/C15H33N3/c1-5-6-7-8-9-15(2,3)14-17(4)12-13-18(14)11-10-16/h14H,5-13,16H2,1-4H3
InChIKeyGHLBYZJYGYTIRO-UHFFFAOYSA-N
XLogP2.52
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.52
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-[3-(2-aminoethyl)-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanol
CID 3022868
2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanol
CID 57356443
4,4-dimethyltridecan-1-amine
CID 172686024
2-(4-hexylpiperazin-1-yl)ethanamine
CID 28913883
3,3-dimethylpentadecan-1-amine
CID 81014127
2-methyl-2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)octan-1-amine
CID 79175486
2-(3-methoxypyrrolidin-1-yl)-2-methylheptan-1-amine
CID 103531540
2,2-dimethyloctan-1-amine
CID 62739423
4-pentadecylheptane-1,4,7-triamine
CID 156536321
10-tert-butylnonadecan-10-amine
CID 20837586
1-(2-methyloctan-2-yl)-2-undecylcyclopropane
CID 153337424
1,3-dimethyl-2-nonylimidazolidine;hydroiodide
CID 173458444

Frequently Asked Questions

What is the IUPAC name of 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine?
The IUPAC name of 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine (CID 57356330) is 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine.
What is the SMILES notation for 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine?
The canonical SMILES for 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine is CCCCCCC(C)(C)C1N(C)CCN1CCN.
What is the InChIKey of 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine?
The InChIKey is GHLBYZJYGYTIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-5-6-7-8-9-15(2,3)14-17(4)12-13-18(14)11-10-16/h14H,5-13,16H2,1-4H3.
What are the key properties of 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine?
2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine has a molecular weight of 255.45 g/mol, XLogP of 2.52, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-methyl-2-(2-methyloctan-2-yl)imidazolidin-1-yl]ethanamine is sourced from PubChem (CID 57356330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).