4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine

C15H31NO3 — CID 104564608

IUPAC4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine
SMILESCCC1CCC(N)C(CCOCCOCCOC)C1
InChIInChI=1S/C15H31NO3/c1-3-13-4-5-15(16)14(12-13)6-7-18-10-11-19-9-8-17-2/h13-15H,3-12,16H2,1-2H3
InChIKeyUCSGROQENXLYQN-UHFFFAOYSA-N
MW273.42 g/mol
LogP2.21
Rot. Bonds10

About 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine

4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine (PubChem CID 104564608) has the molecular formula C15H31NO3 and a molecular weight of 273.42 g/mol. Its IUPAC name is 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine
PubChem CID104564608
Molecular FormulaC15H31NO3
Molecular Weight273.42 g/mol
Exact Mass273.23
IUPAC Name4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine
SMILESCCC1CCC(N)C(CCOCCOCCOC)C1
InChIInChI=1S/C15H31NO3/c1-3-13-4-5-15(16)14(12-13)6-7-18-10-11-19-9-8-17-2/h13-15H,3-12,16H2,1-2H3
InChIKeyUCSGROQENXLYQN-UHFFFAOYSA-N
XLogP2.21
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-ol
CID 104565820
2-[3-(2-methoxyethoxy)propyl]-4-propylcyclohexan-1-amine
CID 103410732
2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclopentan-1-amine
CID 104560818
2-[3-(2-methoxyethoxy)propyl]cyclobutan-1-amine
CID 103415817
2-[2-(4-bromophenoxy)ethyl]-4-ethylcyclohexan-1-amine
CID 63403440
2-[(2-amino-5-ethylcyclohexyl)methyl-(2-methoxyethyl)amino]ethanol
CID 113468089
2-[3-(2-methoxyethoxy)propyl]cyclohexan-1-amine
CID 103410699
1-bromo-2-[3-(2-methoxyethoxy)propyl]-4-propylcyclohexane
CID 103411900
4-propan-2-yl-2-(2-propoxyethyl)cyclohexan-1-amine
CID 106454508
1-bromo-4-ethyl-2-(4-methoxybutyl)cyclohexane
CID 104649056
4-ethyl-2-(propan-2-yloxymethyl)cyclohexan-1-amine
CID 81014934
2-(propoxymethyl)-4-propylcyclohexan-1-amine
CID 81013169

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine?
The IUPAC name of 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine (CID 104564608) is 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine is CCC1CCC(N)C(CCOCCOCCOC)C1.
What is the InChIKey of 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine?
The InChIKey is UCSGROQENXLYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO3/c1-3-13-4-5-15(16)14(12-13)6-7-18-10-11-19-9-8-17-2/h13-15H,3-12,16H2,1-2H3.
What are the key properties of 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine?
4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine has a molecular weight of 273.42 g/mol, XLogP of 2.21, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine is sourced from PubChem (CID 104564608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).