2-cyclohex-2-en-1-yloxy-N-methylethanamine

C9H17NO — CID 58684193

IUPAC2-cyclohex-2-en-1-yloxy-N-methylethanamine
SMILESCNCCOC1C=CCCC1
InChIInChI=1S/C9H17NO/c1-10-7-8-11-9-5-3-2-4-6-9/h3,5,9-10H,2,4,6-8H2,1H3
InChIKeyCHYQOFGYXQFZEP-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.33
Rot. Bonds4

About 2-cyclohex-2-en-1-yloxy-N-methylethanamine

2-cyclohex-2-en-1-yloxy-N-methylethanamine (PubChem CID 58684193) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-cyclohex-2-en-1-yloxy-N-methylethanamine.

Molecular Properties

Compound Name2-cyclohex-2-en-1-yloxy-N-methylethanamine
PubChem CID58684193
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-cyclohex-2-en-1-yloxy-N-methylethanamine
SMILESCNCCOC1C=CCCC1
InChIInChI=1S/C9H17NO/c1-10-7-8-11-9-5-3-2-4-6-9/h3,5,9-10H,2,4,6-8H2,1H3
InChIKeyCHYQOFGYXQFZEP-UHFFFAOYSA-N
XLogP1.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-Cyclohex-2-en-1-yloxypropan-1-amine
CID 58684071
2-Cyclohex-2-en-1-yloxyethanamine
CID 58685132
2-[(4E)-cyclooct-4-en-1-yl]oxy-N-methylethanamine
CID 68017958
2-[(E)-hept-3-en-4-yl]morpholine
CID 68588038
2-Hept-3-en-4-ylmorpholine
CID 68588043
2-Hex-1-enylmorpholine
CID 68588543
2-Pent-1-enylmorpholine
CID 68590333
N-ethyl-2-(4-methylcyclohex-2-en-1-yl)oxyethanamine
CID 70223116
2-cyclooct-4-en-1-yloxy-N-methylethanamine
CID 77387394
2-[(1E,3E)-octa-1,3-dienyl]morpholine
CID 88282315
N-methyl-2-(4-methylcyclohexa-2,4-dien-1-yl)oxyethanamine
CID 123439096
(Z)-N-[(Z)-pent-3-enyl]-4-propan-2-yloxyhept-5-en-3-amine
CID 126489743

Frequently Asked Questions

What is the IUPAC name of 2-cyclohex-2-en-1-yloxy-N-methylethanamine?
The IUPAC name of 2-cyclohex-2-en-1-yloxy-N-methylethanamine (CID 58684193) is 2-cyclohex-2-en-1-yloxy-N-methylethanamine.
What is the SMILES notation for 2-cyclohex-2-en-1-yloxy-N-methylethanamine?
The canonical SMILES for 2-cyclohex-2-en-1-yloxy-N-methylethanamine is CNCCOC1C=CCCC1.
What is the InChIKey of 2-cyclohex-2-en-1-yloxy-N-methylethanamine?
The InChIKey is CHYQOFGYXQFZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-10-7-8-11-9-5-3-2-4-6-9/h3,5,9-10H,2,4,6-8H2,1H3.
What are the key properties of 2-cyclohex-2-en-1-yloxy-N-methylethanamine?
2-cyclohex-2-en-1-yloxy-N-methylethanamine has a molecular weight of 155.24 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohex-2-en-1-yloxy-N-methylethanamine is sourced from PubChem (CID 58684193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).