(3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine

C13H24N2O — CID 142300770

IUPAC(3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine
SMILESC/C=C\C(C)=C(/NC)C(C)N1CCOCC1
InChIInChI=1S/C13H24N2O/c1-5-6-11(2)13(14-4)12(3)15-7-9-16-10-8-15/h5-6,12,14H,7-10H2,1-4H3/b6-5-,13-11-
InChIKeyHFKYCRRYKPCUGE-VNWVSWPHSA-N
MW224.35 g/mol
LogP1.78
Rot. Bonds4

About (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine

(3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine (PubChem CID 142300770) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine.

Molecular Properties

Compound Name(3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine
PubChem CID142300770
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name(3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine
SMILESC/C=C\C(C)=C(/NC)C(C)N1CCOCC1
InChIInChI=1S/C13H24N2O/c1-5-6-11(2)13(14-4)12(3)15-7-9-16-10-8-15/h5-6,12,14H,7-10H2,1-4H3/b6-5-,13-11-
InChIKeyHFKYCRRYKPCUGE-VNWVSWPHSA-N
XLogP1.78
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine with MolForge

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Related Compounds

4-[(3Z,5Z)-3-fluoro-5-(piperazin-1-ylmethyl)hepta-1,3,5-trien-4-yl]morpholine
CID 155070839
3-fluoro-N-methyl-4-morpholin-4-ylcyclohepta-2,4,6-trien-1-amine
CID 143162412
4-[(Z)-3-(piperazin-1-ylmethyl)pent-3-en-2-yl]morpholine
CID 18547154
4-[3-(Piperazin-1-ylmethyl)pent-3-en-2-yl]morpholine
CID 70025715
N-ethyl-2-(2-morpholin-4-ylethyl)cyclohexa-1,3-dien-1-amine
CID 70333386
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,2-dimethylcyclohexa-2,4-dien-1-amine
CID 70892577
4-(2,6-Dimethylmorpholin-4-yl)cyclohexa-2,4-dien-1-amine
CID 70892610
4-[(2R)-2,6-dimethylmorpholin-4-yl]cyclohexa-2,4-dien-1-amine
CID 70974382
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]cyclohexa-2,4-dien-1-amine
CID 70974386
4-(2,6-Dimethylmorpholin-4-yl)-2-methylcyclohexa-1,5-dien-1-amine
CID 70974452
3-(2,6-Dimethylmorpholin-4-yl)cyclohexa-2,4-dien-1-amine
CID 70974472
(2E,4Z)-4-(morpholin-4-ylmethyl)hepta-2,4,6-trien-3-amine
CID 88905167

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine?
The IUPAC name of (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine (CID 142300770) is (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine.
What is the SMILES notation for (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine?
The canonical SMILES for (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine is C/C=C\C(C)=C(/NC)C(C)N1CCOCC1.
What is the InChIKey of (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine?
The InChIKey is HFKYCRRYKPCUGE-VNWVSWPHSA-N. The full InChI is InChI=1S/C13H24N2O/c1-5-6-11(2)13(14-4)12(3)15-7-9-16-10-8-15/h5-6,12,14H,7-10H2,1-4H3/b6-5-,13-11-.
What are the key properties of (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine?
(3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine has a molecular weight of 224.35 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-N,4-dimethyl-2-morpholin-4-ylhepta-3,5-dien-3-amine is sourced from PubChem (CID 142300770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).