(Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine

C17H33N3O2 — CID 134419180

IUPAC(Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine
SMILESC/C(=C/CN1CCOCC1)CCCNCCN1CCOCC1
InChIInChI=1S/C17H33N3O2/c1-17(4-7-19-9-13-21-14-10-19)3-2-5-18-6-8-20-11-15-22-16-12-20/h4,18H,2-3,5-16H2,1H3/b17-4-
InChIKeyRUYGBKMLIWJGSG-INGKJJEOSA-N
MW311.47 g/mol
LogP0.97
Rot. Bonds9

About (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine

(Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine (PubChem CID 134419180) has the molecular formula C17H33N3O2 and a molecular weight of 311.47 g/mol. Its IUPAC name is (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine.

Molecular Properties

Compound Name(Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine
PubChem CID134419180
Molecular FormulaC17H33N3O2
Molecular Weight311.47 g/mol
Exact Mass311.26
IUPAC Name(Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine
SMILESC/C(=C/CN1CCOCC1)CCCNCCN1CCOCC1
InChIInChI=1S/C17H33N3O2/c1-17(4-7-19-9-13-21-14-10-19)3-2-5-18-6-8-20-11-15-22-16-12-20/h4,18H,2-3,5-16H2,1H3/b17-4-
InChIKeyRUYGBKMLIWJGSG-INGKJJEOSA-N
XLogP0.97
TPSA36.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.47
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine?
The IUPAC name of (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine (CID 134419180) is (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine.
What is the SMILES notation for (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine?
The canonical SMILES for (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine is C/C(=C/CN1CCOCC1)CCCNCCN1CCOCC1.
What is the InChIKey of (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine?
The InChIKey is RUYGBKMLIWJGSG-INGKJJEOSA-N. The full InChI is InChI=1S/C17H33N3O2/c1-17(4-7-19-9-13-21-14-10-19)3-2-5-18-6-8-20-11-15-22-16-12-20/h4,18H,2-3,5-16H2,1H3/b17-4-.
What are the key properties of (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine?
(Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine has a molecular weight of 311.47 g/mol, XLogP of 0.97, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylethyl)hex-4-en-1-amine is sourced from PubChem (CID 134419180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).