5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine

C14H28N2O — CID 173348749

IUPAC5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine
SMILESCN(C)CCC=CCOCC=CCCN(C)C
InChIInChI=1S/C14H28N2O/c1-15(2)11-7-5-9-13-17-14-10-6-8-12-16(3)4/h5-6,9-10H,7-8,11-14H2,1-4H3
InChIKeyORZCXEISIKEHHV-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.02
Rot. Bonds10

About 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine

5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine (PubChem CID 173348749) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine.

Molecular Properties

Compound Name5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine
PubChem CID173348749
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine
SMILESCN(C)CCC=CCOCC=CCCN(C)C
InChIInChI=1S/C14H28N2O/c1-15(2)11-7-5-9-13-17-14-10-6-8-12-16(3)4/h5-6,9-10H,7-8,11-14H2,1-4H3
InChIKeyORZCXEISIKEHHV-UHFFFAOYSA-N
XLogP2.02
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.02
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine?
The IUPAC name of 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine (CID 173348749) is 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine.
What is the SMILES notation for 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine?
The canonical SMILES for 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine is CN(C)CCC=CCOCC=CCCN(C)C.
What is the InChIKey of 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine?
The InChIKey is ORZCXEISIKEHHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-15(2)11-7-5-9-13-17-14-10-6-8-12-16(3)4/h5-6,9-10H,7-8,11-14H2,1-4H3.
What are the key properties of 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine?
5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine has a molecular weight of 240.39 g/mol, XLogP of 2.02, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(dimethylamino)pent-2-enoxy]-N,N-dimethylpent-3-en-1-amine is sourced from PubChem (CID 173348749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).