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

C14H26N2 — CID 23267229

IUPAC(1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine
SMILESC/C=C/C=C(/N(CC)CC)N1CCCCC1
InChIInChI=1S/C14H26N2/c1-4-7-11-14(15(5-2)6-3)16-12-9-8-10-13-16/h4,7,11H,5-6,8-10,12-13H2,1-3H3/b7-4+,14-11-
InChIKeyKWIWBPKHXSVVTE-VWLNWXJOSA-N
MW222.38 g/mol
LogP3.23
Rot. Bonds5

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

(1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine (PubChem CID 23267229) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine.

Molecular Properties

Compound Name(1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine
PubChem CID23267229
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name(1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine
SMILESC/C=C/C=C(/N(CC)CC)N1CCCCC1
InChIInChI=1S/C14H26N2/c1-4-7-11-14(15(5-2)6-3)16-12-9-8-10-13-16/h4,7,11H,5-6,8-10,12-13H2,1-3H3/b7-4+,14-11-
InChIKeyKWIWBPKHXSVVTE-VWLNWXJOSA-N
XLogP3.23
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine with MolForge

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Related Compounds

(1Z)-N,N-diethyl-4-methyl-1-piperidin-1-ylpenta-1,3-dien-1-amine
CID 23265319
(1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine
CID 134923532
1-(piperidin-1-ylmethyl)-2H-pyridine
CID 409552
1-methyl-N,N-dipropyl-2H-pyridin-6-amine
CID 56612432
1-methyl-6-piperidin-1-yl-2H-pyridine
CID 56618453
2-piperidin-1-yl-1H-azepine
CID 89579466
2-(2,3-Dihydropyrrol-1-yl)-1-propylpiperidine
CID 118090868
(1E,3Z)-1-piperidin-1-ylpenta-1,3-diene-1,4-diamine
CID 134406452
N-[(1Z,3Z)-1-piperidin-1-ylpenta-1,3-dienyl]methanimine
CID 144281614
ethane;(1E,3Z)-1-piperidin-1-ylpenta-1,3-diene-1,4-diamine
CID 145198069
1-methyl-2-piperidin-1-yl-2H-pyridine
CID 145592190
1-[(1E,3E)-penta-1,3-dienyl]piperidine
CID 173339982

Frequently Asked Questions

What is the IUPAC name of (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine?
The IUPAC name of (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine (CID 23267229) is (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine.
What is the SMILES notation for (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine?
The canonical SMILES for (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine is C/C=C/C=C(/N(CC)CC)N1CCCCC1.
What is the InChIKey of (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine?
The InChIKey is KWIWBPKHXSVVTE-VWLNWXJOSA-N. The full InChI is InChI=1S/C14H26N2/c1-4-7-11-14(15(5-2)6-3)16-12-9-8-10-13-16/h4,7,11H,5-6,8-10,12-13H2,1-3H3/b7-4+,14-11-.
What are the key properties of (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine?
(1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine has a molecular weight of 222.38 g/mol, XLogP of 3.23, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine is sourced from PubChem (CID 23267229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).