(Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine

C11H23NO — CID 103392178

IUPAC(Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine
SMILESCCC(C)/C=C(/CCCN)COC
InChIInChI=1S/C11H23NO/c1-4-10(2)8-11(9-13-3)6-5-7-12/h8,10H,4-7,9,12H2,1-3H3/b11-8-
InChIKeyDYYBDVHWLBEWTJ-FLIBITNWSA-N
MW185.31 g/mol
LogP2.34
Rot. Bonds7

About (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine

(Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine (PubChem CID 103392178) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine.

Molecular Properties

Compound Name(Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine
PubChem CID103392178
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name(Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine
SMILESCCC(C)/C=C(/CCCN)COC
InChIInChI=1S/C11H23NO/c1-4-10(2)8-11(9-13-3)6-5-7-12/h8,10H,4-7,9,12H2,1-3H3/b11-8-
InChIKeyDYYBDVHWLBEWTJ-FLIBITNWSA-N
XLogP2.34
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine?
The IUPAC name of (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine (CID 103392178) is (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine.
What is the SMILES notation for (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine?
The canonical SMILES for (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine is CCC(C)/C=C(/CCCN)COC.
What is the InChIKey of (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine?
The InChIKey is DYYBDVHWLBEWTJ-FLIBITNWSA-N. The full InChI is InChI=1S/C11H23NO/c1-4-10(2)8-11(9-13-3)6-5-7-12/h8,10H,4-7,9,12H2,1-3H3/b11-8-.
What are the key properties of (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine?
(Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine has a molecular weight of 185.31 g/mol, XLogP of 2.34, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-(methoxymethyl)-6-methyloct-4-en-1-amine is sourced from PubChem (CID 103392178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).