(Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine

C15H30N2O — CID 70892385

IUPAC(Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine
SMILESCCC(N)/C(C)=C(/C)CN1CC(C)OC(C)C1C
InChIInChI=1S/C15H30N2O/c1-7-15(16)12(4)10(2)8-17-9-11(3)18-14(6)13(17)5/h11,13-15H,7-9,16H2,1-6H3/b12-10-
InChIKeyXBIDMKHLRLAUKX-BENRWUELSA-N
MW254.42 g/mol
LogP2.56
Rot. Bonds4

About (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine

(Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine (PubChem CID 70892385) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine.

Molecular Properties

Compound Name(Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine
PubChem CID70892385
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name(Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine
SMILESCCC(N)/C(C)=C(/C)CN1CC(C)OC(C)C1C
InChIInChI=1S/C15H30N2O/c1-7-15(16)12(4)10(2)8-17-9-11(3)18-14(6)13(17)5/h11,13-15H,7-9,16H2,1-6H3/b12-10-
InChIKeyXBIDMKHLRLAUKX-BENRWUELSA-N
XLogP2.56
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine?
The IUPAC name of (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine (CID 70892385) is (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine.
What is the SMILES notation for (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine?
The canonical SMILES for (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine is CCC(N)/C(C)=C(/C)CN1CC(C)OC(C)C1C.
What is the InChIKey of (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine?
The InChIKey is XBIDMKHLRLAUKX-BENRWUELSA-N. The full InChI is InChI=1S/C15H30N2O/c1-7-15(16)12(4)10(2)8-17-9-11(3)18-14(6)13(17)5/h11,13-15H,7-9,16H2,1-6H3/b12-10-.
What are the key properties of (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine?
(Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine has a molecular weight of 254.42 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4,5-dimethyl-6-(2,3,6-trimethylmorpholin-4-yl)hex-4-en-3-amine is sourced from PubChem (CID 70892385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).