N,4-bis(prop-2-enyl)oct-1-en-4-amine

C14H25N — CID 87877491

IUPACN,4-bis(prop-2-enyl)oct-1-en-4-amine
SMILESC=CCNC(CC=C)(CC=C)CCCC
InChIInChI=1S/C14H25N/c1-5-9-12-14(10-6-2,11-7-3)15-13-8-4/h6-8,15H,2-5,9-13H2,1H3
InChIKeyQQPJLHXESUIVJK-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.84
Rot. Bonds10

About N,4-bis(prop-2-enyl)oct-1-en-4-amine

N,4-bis(prop-2-enyl)oct-1-en-4-amine (PubChem CID 87877491) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N,4-bis(prop-2-enyl)oct-1-en-4-amine.

Molecular Properties

Compound NameN,4-bis(prop-2-enyl)oct-1-en-4-amine
PubChem CID87877491
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN,4-bis(prop-2-enyl)oct-1-en-4-amine
SMILESC=CCNC(CC=C)(CC=C)CCCC
InChIInChI=1S/C14H25N/c1-5-9-12-14(10-6-2,11-7-3)15-13-8-4/h6-8,15H,2-5,9-13H2,1H3
InChIKeyQQPJLHXESUIVJK-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,4-bis(prop-2-enyl)oct-1-en-4-amine?
The IUPAC name of N,4-bis(prop-2-enyl)oct-1-en-4-amine (CID 87877491) is N,4-bis(prop-2-enyl)oct-1-en-4-amine.
What is the SMILES notation for N,4-bis(prop-2-enyl)oct-1-en-4-amine?
The canonical SMILES for N,4-bis(prop-2-enyl)oct-1-en-4-amine is C=CCNC(CC=C)(CC=C)CCCC.
What is the InChIKey of N,4-bis(prop-2-enyl)oct-1-en-4-amine?
The InChIKey is QQPJLHXESUIVJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-5-9-12-14(10-6-2,11-7-3)15-13-8-4/h6-8,15H,2-5,9-13H2,1H3.
What are the key properties of N,4-bis(prop-2-enyl)oct-1-en-4-amine?
N,4-bis(prop-2-enyl)oct-1-en-4-amine has a molecular weight of 207.36 g/mol, XLogP of 3.84, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-bis(prop-2-enyl)oct-1-en-4-amine is sourced from PubChem (CID 87877491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).