5-(2-methoxyethoxy)pent-1-en-3-amine

C8H17NO2 — CID 102927827

IUPAC5-(2-methoxyethoxy)pent-1-en-3-amine
SMILESC=CC(N)CCOCCOC
InChIInChI=1S/C8H17NO2/c1-3-8(9)4-5-11-7-6-10-2/h3,8H,1,4-7,9H2,2H3
InChIKeyQDWJMGYYDYXJGV-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.55
Rot. Bonds7

About 5-(2-methoxyethoxy)pent-1-en-3-amine

5-(2-methoxyethoxy)pent-1-en-3-amine (PubChem CID 102927827) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 5-(2-methoxyethoxy)pent-1-en-3-amine.

Molecular Properties

Compound Name5-(2-methoxyethoxy)pent-1-en-3-amine
PubChem CID102927827
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name5-(2-methoxyethoxy)pent-1-en-3-amine
SMILESC=CC(N)CCOCCOC
InChIInChI=1S/C8H17NO2/c1-3-8(9)4-5-11-7-6-10-2/h3,8H,1,4-7,9H2,2H3
InChIKeyQDWJMGYYDYXJGV-UHFFFAOYSA-N
XLogP0.55
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-[2-(2-Pent-4-enoxyethoxy)ethoxy]propan-1-amine
CID 130215979
(3R)-5-methoxypent-1-en-3-amine
CID 137495270
1-[2-(2-Aminobut-3-enoxy)ethoxy]butan-2-amine
CID 142759994
5-Methoxypent-1-en-3-amine
CID 65575977
1-(2-Methoxyethoxy)hex-5-en-3-amine
CID 102927773
1-(2-Methoxyethoxy)hept-6-en-3-amine
CID 102927819
5-(2-Methoxyethoxy)-2-methylpent-1-en-3-amine
CID 102927828
1-(2-Methoxyethoxy)-5-methylhex-4-en-3-amine
CID 102927899
1-(2-methoxyethoxy)-N-methylhex-5-en-3-amine
CID 102928036
5-(2-methoxyethoxy)-N-methylpent-1-en-3-amine
CID 102928088
N-ethyl-5-(2-methoxyethoxy)pent-1-en-3-amine
CID 102928352
5-(2-methoxyethoxy)-N-propylpent-1-en-3-amine
CID 102928581

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyethoxy)pent-1-en-3-amine?
The IUPAC name of 5-(2-methoxyethoxy)pent-1-en-3-amine (CID 102927827) is 5-(2-methoxyethoxy)pent-1-en-3-amine.
What is the SMILES notation for 5-(2-methoxyethoxy)pent-1-en-3-amine?
The canonical SMILES for 5-(2-methoxyethoxy)pent-1-en-3-amine is C=CC(N)CCOCCOC.
What is the InChIKey of 5-(2-methoxyethoxy)pent-1-en-3-amine?
The InChIKey is QDWJMGYYDYXJGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-3-8(9)4-5-11-7-6-10-2/h3,8H,1,4-7,9H2,2H3.
What are the key properties of 5-(2-methoxyethoxy)pent-1-en-3-amine?
5-(2-methoxyethoxy)pent-1-en-3-amine has a molecular weight of 159.23 g/mol, XLogP of 0.55, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyethoxy)pent-1-en-3-amine is sourced from PubChem (CID 102927827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).