1-(cyclohexen-1-yl)-2-ethoxyethanamine

C10H19NO — CID 106653369

IUPAC1-(cyclohexen-1-yl)-2-ethoxyethanamine
SMILESCCOCC(N)C1=CCCCC1
InChIInChI=1S/C10H19NO/c1-2-12-8-10(11)9-6-4-3-5-7-9/h6,10H,2-5,7-8,11H2,1H3
InChIKeyLRLACJACFJIYQE-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.85
Rot. Bonds4

About 1-(cyclohexen-1-yl)-2-ethoxyethanamine

1-(cyclohexen-1-yl)-2-ethoxyethanamine (PubChem CID 106653369) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)-2-ethoxyethanamine.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)-2-ethoxyethanamine
PubChem CID106653369
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(cyclohexen-1-yl)-2-ethoxyethanamine
SMILESCCOCC(N)C1=CCCCC1
InChIInChI=1S/C10H19NO/c1-2-12-8-10(11)9-6-4-3-5-7-9/h6,10H,2-5,7-8,11H2,1H3
InChIKeyLRLACJACFJIYQE-UHFFFAOYSA-N
XLogP1.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(cyclohepten-1-yl)-2-propoxyethanamine
CID 106652723
1-(cyclohepten-1-yl)-4-ethoxybutan-1-amine
CID 106657181
1-(cyclohexen-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 106657502
(1R)-1-(cyclopenten-1-yl)propan-1-amine
CID 82763490
1-(cyclohexen-1-yl)butan-1-amine
CID 62079375
1-(cycloocten-1-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
CID 106654843
1-(cyclohepten-1-yl)-3-methoxypropan-1-amine
CID 106652645
1-(cycloocten-1-yl)-3-methylbutan-1-amine
CID 106652467
1-(cyclohepten-1-yl)-2,2-diethoxyethanamine
CID 106653819
1-(cyclohepten-1-yl)heptan-1-amine
CID 114752507
1-(cycloocten-1-yl)-2-ethoxybutan-1-amine
CID 106654440
[1-(cycloocten-1-yl)-3-ethoxypropyl]hydrazine
CID 106650004

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)-2-ethoxyethanamine?
The IUPAC name of 1-(cyclohexen-1-yl)-2-ethoxyethanamine (CID 106653369) is 1-(cyclohexen-1-yl)-2-ethoxyethanamine.
What is the SMILES notation for 1-(cyclohexen-1-yl)-2-ethoxyethanamine?
The canonical SMILES for 1-(cyclohexen-1-yl)-2-ethoxyethanamine is CCOCC(N)C1=CCCCC1.
What is the InChIKey of 1-(cyclohexen-1-yl)-2-ethoxyethanamine?
The InChIKey is LRLACJACFJIYQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-12-8-10(11)9-6-4-3-5-7-9/h6,10H,2-5,7-8,11H2,1H3.
What are the key properties of 1-(cyclohexen-1-yl)-2-ethoxyethanamine?
1-(cyclohexen-1-yl)-2-ethoxyethanamine has a molecular weight of 169.27 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)-2-ethoxyethanamine is sourced from PubChem (CID 106653369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).