1-ethoxy-N-methylnon-8-en-4-amine

C12H25NO — CID 105153065

IUPAC1-ethoxy-N-methylnon-8-en-4-amine
SMILESC=CCCCC(CCCOCC)NC
InChIInChI=1S/C12H25NO/c1-4-6-7-9-12(13-3)10-8-11-14-5-2/h4,12-13H,1,5-11H2,2-3H3
InChIKeySPEYHVCSDAUBJA-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.75
Rot. Bonds10

About 1-ethoxy-N-methylnon-8-en-4-amine

1-ethoxy-N-methylnon-8-en-4-amine (PubChem CID 105153065) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 1-ethoxy-N-methylnon-8-en-4-amine.

Molecular Properties

Compound Name1-ethoxy-N-methylnon-8-en-4-amine
PubChem CID105153065
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name1-ethoxy-N-methylnon-8-en-4-amine
SMILESC=CCCCC(CCCOCC)NC
InChIInChI=1S/C12H25NO/c1-4-6-7-9-12(13-3)10-8-11-14-5-2/h4,12-13H,1,5-11H2,2-3H3
InChIKeySPEYHVCSDAUBJA-UHFFFAOYSA-N
XLogP2.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-ethoxy-N-propyloct-7-en-4-amine
CID 105153556
N-methylpentadec-1-en-8-amine
CID 107011425
1-cyclobutyl-5-ethoxy-N-methylpentan-2-amine
CID 105151604
1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine
CID 105135620
1-ethoxy-N-ethylnon-8-en-2-amine
CID 107009273
11-(2-ethoxyethoxy)undec-1-ene
CID 142718569
11-[2-(2-ethoxyethoxy)ethoxy]undec-1-ene
CID 142718592
6-ethoxy-1-methoxy-N-methylhexan-2-amine
CID 65180928
4-ethoxybut-1-ene
CID 533994
(2R)-5-ethoxy-N-methylpentan-2-amine
CID 93424576
1-methoxy-N-propylnon-8-en-4-amine
CID 65091822
1-ethoxyhept-6-en-3-ylhydrazine
CID 105311649

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-methylnon-8-en-4-amine?
The IUPAC name of 1-ethoxy-N-methylnon-8-en-4-amine (CID 105153065) is 1-ethoxy-N-methylnon-8-en-4-amine.
What is the SMILES notation for 1-ethoxy-N-methylnon-8-en-4-amine?
The canonical SMILES for 1-ethoxy-N-methylnon-8-en-4-amine is C=CCCCC(CCCOCC)NC.
What is the InChIKey of 1-ethoxy-N-methylnon-8-en-4-amine?
The InChIKey is SPEYHVCSDAUBJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-4-6-7-9-12(13-3)10-8-11-14-5-2/h4,12-13H,1,5-11H2,2-3H3.
What are the key properties of 1-ethoxy-N-methylnon-8-en-4-amine?
1-ethoxy-N-methylnon-8-en-4-amine has a molecular weight of 199.34 g/mol, XLogP of 2.75, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-methylnon-8-en-4-amine is sourced from PubChem (CID 105153065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).