(1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine

C13H24N2O — CID 134923648

IUPAC(1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine
SMILESC/C=C/C=C(/N(CC)CC)N1CCOCC1
InChIInChI=1S/C13H24N2O/c1-4-7-8-13(14(5-2)6-3)15-9-11-16-12-10-15/h4,7-8H,5-6,9-12H2,1-3H3/b7-4+,13-8-
InChIKeyQBCYVYXNOUGIKT-XOHVCTMJSA-N
MW224.35 g/mol
LogP2.08
Rot. Bonds5

About (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine

(1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine (PubChem CID 134923648) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine.

Molecular Properties

Compound Name(1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine
PubChem CID134923648
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name(1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine
SMILESC/C=C/C=C(/N(CC)CC)N1CCOCC1
InChIInChI=1S/C13H24N2O/c1-4-7-8-13(14(5-2)6-3)15-9-11-16-12-10-15/h4,7-8H,5-6,9-12H2,1-3H3/b7-4+,13-8-
InChIKeyQBCYVYXNOUGIKT-XOHVCTMJSA-N
XLogP2.08
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-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 (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine?
The IUPAC name of (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine (CID 134923648) is (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine.
What is the SMILES notation for (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine?
The canonical SMILES for (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine is C/C=C/C=C(/N(CC)CC)N1CCOCC1.
What is the InChIKey of (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine?
The InChIKey is QBCYVYXNOUGIKT-XOHVCTMJSA-N. The full InChI is InChI=1S/C13H24N2O/c1-4-7-8-13(14(5-2)6-3)15-9-11-16-12-10-15/h4,7-8H,5-6,9-12H2,1-3H3/b7-4+,13-8-.
What are the key properties of (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine?
(1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine has a molecular weight of 224.35 g/mol, XLogP of 2.08, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E)-N,N-diethyl-1-morpholin-4-ylpenta-1,3-dien-1-amine is sourced from PubChem (CID 134923648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).