2-(2-prop-2-enylpent-4-enoxy)ethanamine

C10H19NO — CID 140553377

IUPAC2-(2-prop-2-enylpent-4-enoxy)ethanamine
SMILESC=CCC(CC=C)COCCN
InChIInChI=1S/C10H19NO/c1-3-5-10(6-4-2)9-12-8-7-11/h3-4,10H,1-2,5-9,11H2
InChIKeyOLHZMQYKXYKQOS-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.73
Rot. Bonds8

About 2-(2-prop-2-enylpent-4-enoxy)ethanamine

2-(2-prop-2-enylpent-4-enoxy)ethanamine (PubChem CID 140553377) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-(2-prop-2-enylpent-4-enoxy)ethanamine.

Molecular Properties

Compound Name2-(2-prop-2-enylpent-4-enoxy)ethanamine
PubChem CID140553377
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-(2-prop-2-enylpent-4-enoxy)ethanamine
SMILESC=CCC(CC=C)COCCN
InChIInChI=1S/C10H19NO/c1-3-5-10(6-4-2)9-12-8-7-11/h3-4,10H,1-2,5-9,11H2
InChIKeyOLHZMQYKXYKQOS-UHFFFAOYSA-N
XLogP1.73
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.73
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

2-Hex-5-enoxyethanamine
CID 59316214
1-(2-Prop-2-enylpent-4-enoxy)ethanamine
CID 87283413
2-(Cyclohex-3-en-1-ylmethoxy)ethanamine
CID 89197335
(2R)-1-hept-6-enoxy-3-methylbutan-2-amine
CID 90282345
2-[(Z)-3-methylhept-5-en-2-yl]oxyethanamine
CID 173711887
3-Methyl-2-pent-4-enoxybutan-1-amine
CID 79114889
2-(2-Methoxyethyl)pent-4-en-1-amine
CID 130906794

Frequently Asked Questions

What is the IUPAC name of 2-(2-prop-2-enylpent-4-enoxy)ethanamine?
The IUPAC name of 2-(2-prop-2-enylpent-4-enoxy)ethanamine (CID 140553377) is 2-(2-prop-2-enylpent-4-enoxy)ethanamine.
What is the SMILES notation for 2-(2-prop-2-enylpent-4-enoxy)ethanamine?
The canonical SMILES for 2-(2-prop-2-enylpent-4-enoxy)ethanamine is C=CCC(CC=C)COCCN.
What is the InChIKey of 2-(2-prop-2-enylpent-4-enoxy)ethanamine?
The InChIKey is OLHZMQYKXYKQOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-5-10(6-4-2)9-12-8-7-11/h3-4,10H,1-2,5-9,11H2.
What are the key properties of 2-(2-prop-2-enylpent-4-enoxy)ethanamine?
2-(2-prop-2-enylpent-4-enoxy)ethanamine has a molecular weight of 169.27 g/mol, XLogP of 1.73, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-prop-2-enylpent-4-enoxy)ethanamine is sourced from PubChem (CID 140553377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).