2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine

C15H26N2O2 — CID 89325509

IUPAC2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine
SMILESC=COCCCNC(=C)CC(=C)NCCCOC=C
InChIInChI=1S/C15H26N2O2/c1-5-18-11-7-9-16-14(3)13-15(4)17-10-8-12-19-6-2/h5-6,16-17H,1-4,7-13H2
InChIKeyBUSHZIJTMXSOJW-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.68
Rot. Bonds14

About 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine

2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine (PubChem CID 89325509) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine
PubChem CID89325509
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine
SMILESC=COCCCNC(=C)CC(=C)NCCCOC=C
InChIInChI=1S/C15H26N2O2/c1-5-18-11-7-9-16-14(3)13-15(4)17-10-8-12-19-6-2/h5-6,16-17H,1-4,7-13H2
InChIKeyBUSHZIJTMXSOJW-UHFFFAOYSA-N
XLogP2.68
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine?
The IUPAC name of 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine (CID 89325509) is 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine.
What is the SMILES notation for 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine?
The canonical SMILES for 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine is C=COCCCNC(=C)CC(=C)NCCCOC=C.
What is the InChIKey of 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine?
The InChIKey is BUSHZIJTMXSOJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-5-18-11-7-9-16-14(3)13-15(4)17-10-8-12-19-6-2/h5-6,16-17H,1-4,7-13H2.
What are the key properties of 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine?
2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine has a molecular weight of 266.38 g/mol, XLogP of 2.68, 14 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-bis(3-ethenoxypropyl)penta-1,4-diene-2,4-diamine is sourced from PubChem (CID 89325509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).