6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine

C10H21NO2 — CID 103392147

IUPAC6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine
SMILESCOCC(C)=C(CCCN)COC
InChIInChI=1S/C10H21NO2/c1-9(7-12-2)10(8-13-3)5-4-6-11/h4-8,11H2,1-3H3
InChIKeyUKBJAFCDAJKBQG-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.33
Rot. Bonds7

About 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine

6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine (PubChem CID 103392147) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine.

Molecular Properties

Compound Name6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine
PubChem CID103392147
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine
SMILESCOCC(C)=C(CCCN)COC
InChIInChI=1S/C10H21NO2/c1-9(7-12-2)10(8-13-3)5-4-6-11/h4-8,11H2,1-3H3
InChIKeyUKBJAFCDAJKBQG-UHFFFAOYSA-N
XLogP1.33
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

8,8,8-Trifluoro-4-(methoxymethyl)oct-4-en-1-amine
CID 103392090
7,7,7-Trifluoro-4-(methoxymethyl)hept-4-en-1-amine
CID 103392123
(Z)-5-methoxy-3-(2-methoxypropyl)hex-3-en-1-amine
CID 155228105
(3Z)-5-methoxy-3-(2-methoxyethylidene)hexan-1-amine
CID 155228157
4-Cycloheptylidene-5-methoxypentan-1-amine
CID 103392066
4-(Methoxymethyl)hex-4-en-1-amine
CID 103392067
4-(Methoxymethyl)-6-methylhept-4-en-1-amine
CID 103392068
(Z)-4-(methoxymethyl)dec-4-en-1-amine
CID 103392069
(Z)-4-(methoxymethyl)non-4-en-1-amine
CID 103392070
(Z)-4-(methoxymethyl)dodec-4-en-1-amine
CID 103392071
4-(Methoxymethyl)-5-(oxolan-2-yl)pent-4-en-1-amine
CID 103392075
(Z)-4-(methoxymethyl)-6-methylideneoct-4-en-1-amine
CID 103392077

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine?
The IUPAC name of 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine (CID 103392147) is 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine.
What is the SMILES notation for 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine?
The canonical SMILES for 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine is COCC(C)=C(CCCN)COC.
What is the InChIKey of 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine?
The InChIKey is UKBJAFCDAJKBQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-9(7-12-2)10(8-13-3)5-4-6-11/h4-8,11H2,1-3H3.
What are the key properties of 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine?
6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine has a molecular weight of 187.28 g/mol, XLogP of 1.33, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-(methoxymethyl)-5-methylhex-4-en-1-amine is sourced from PubChem (CID 103392147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).