8-ethylimino-N,N-dimethyloct-7-en-1-amine

C12H24N2 — CID 126710228

IUPAC8-ethylimino-N,N-dimethyloct-7-en-1-amine
SMILESCCN=C=CCCCCCCN(C)C
InChIInChI=1S/C12H24N2/c1-4-13-11-9-7-5-6-8-10-12-14(2)3/h9H,4-8,10,12H2,1-3H3
InChIKeyNCEYXMMPAFTYCV-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.74
Rot. Bonds8

About 8-ethylimino-N,N-dimethyloct-7-en-1-amine

8-ethylimino-N,N-dimethyloct-7-en-1-amine (PubChem CID 126710228) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 8-ethylimino-N,N-dimethyloct-7-en-1-amine.

Molecular Properties

Compound Name8-ethylimino-N,N-dimethyloct-7-en-1-amine
PubChem CID126710228
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name8-ethylimino-N,N-dimethyloct-7-en-1-amine
SMILESCCN=C=CCCCCCCN(C)C
InChIInChI=1S/C12H24N2/c1-4-13-11-9-7-5-6-8-10-12-14(2)3/h9H,4-8,10,12H2,1-3H3
InChIKeyNCEYXMMPAFTYCV-UHFFFAOYSA-N
XLogP2.74
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-ethylimino-N,N-dimethyloct-7-en-1-amine?
The IUPAC name of 8-ethylimino-N,N-dimethyloct-7-en-1-amine (CID 126710228) is 8-ethylimino-N,N-dimethyloct-7-en-1-amine.
What is the SMILES notation for 8-ethylimino-N,N-dimethyloct-7-en-1-amine?
The canonical SMILES for 8-ethylimino-N,N-dimethyloct-7-en-1-amine is CCN=C=CCCCCCCN(C)C.
What is the InChIKey of 8-ethylimino-N,N-dimethyloct-7-en-1-amine?
The InChIKey is NCEYXMMPAFTYCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-4-13-11-9-7-5-6-8-10-12-14(2)3/h9H,4-8,10,12H2,1-3H3.
What are the key properties of 8-ethylimino-N,N-dimethyloct-7-en-1-amine?
8-ethylimino-N,N-dimethyloct-7-en-1-amine has a molecular weight of 196.34 g/mol, XLogP of 2.74, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethylimino-N,N-dimethyloct-7-en-1-amine is sourced from PubChem (CID 126710228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).