(E)-N-pent-4-en-2-yloxyprop-1-en-1-amine

C8H15NO — CID 57033610

IUPAC(E)-N-pent-4-en-2-yloxyprop-1-en-1-amine
SMILESC=CCC(C)ON/C=C/C
InChIInChI=1S/C8H15NO/c1-4-6-8(3)10-9-7-5-2/h4-5,7-9H,1,6H2,2-3H3/b7-5+
InChIKeyVDURRLPILNLKKT-FNORWQNLSA-N
MW141.21 g/mol
LogP2.01
Rot. Bonds5

About (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine

(E)-N-pent-4-en-2-yloxyprop-1-en-1-amine (PubChem CID 57033610) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine.

Molecular Properties

Compound Name(E)-N-pent-4-en-2-yloxyprop-1-en-1-amine
PubChem CID57033610
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(E)-N-pent-4-en-2-yloxyprop-1-en-1-amine
SMILESC=CCC(C)ON/C=C/C
InChIInChI=1S/C8H15NO/c1-4-6-8(3)10-9-7-5-2/h4-5,7-9H,1,6H2,2-3H3/b7-5+
InChIKeyVDURRLPILNLKKT-FNORWQNLSA-N
XLogP2.01
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine?
The IUPAC name of (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine (CID 57033610) is (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine.
What is the SMILES notation for (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine?
The canonical SMILES for (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine is C=CCC(C)ON/C=C/C.
What is the InChIKey of (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine?
The InChIKey is VDURRLPILNLKKT-FNORWQNLSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-6-8(3)10-9-7-5-2/h4-5,7-9H,1,6H2,2-3H3/b7-5+.
What are the key properties of (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine?
(E)-N-pent-4-en-2-yloxyprop-1-en-1-amine has a molecular weight of 141.21 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-pent-4-en-2-yloxyprop-1-en-1-amine is sourced from PubChem (CID 57033610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).