(1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine

C16H30N2 — CID 134923532

IUPAC(1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine
SMILESC/C=C/C=C(/N(CCC)CCC)N1CCCCC1
InChIInChI=1S/C16H30N2/c1-4-7-11-16(17(12-5-2)13-6-3)18-14-9-8-10-15-18/h4,7,11H,5-6,8-10,12-15H2,1-3H3/b7-4+,16-11-
InChIKeyZPTOWYDWHUZIND-CHLGNXTCSA-N
MW250.43 g/mol
LogP4.01
Rot. Bonds7

About (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine

(1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine (PubChem CID 134923532) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine.

Molecular Properties

Compound Name(1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine
PubChem CID134923532
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name(1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine
SMILESC/C=C/C=C(/N(CCC)CCC)N1CCCCC1
InChIInChI=1S/C16H30N2/c1-4-7-11-16(17(12-5-2)13-6-3)18-14-9-8-10-15-18/h4,7,11H,5-6,8-10,12-15H2,1-3H3/b7-4+,16-11-
InChIKeyZPTOWYDWHUZIND-CHLGNXTCSA-N
XLogP4.01
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-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)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine
CID 23267229
1-(piperidin-1-ylmethyl)-2H-pyridine
CID 409552
1-methyl-6-piperidin-1-yl-2H-pyridine
CID 56618453
N-[(1Z,3Z)-1-piperidin-1-ylpenta-1,3-dienyl]methanimine
CID 144281614
1-methyl-2-piperidin-1-yl-2H-pyridine
CID 145592190
N-ethyl-N-[(4-piperidin-1-yl-2H-pyridin-1-yl)methyl]ethanamine
CID 20646158
(1Z,3Z)-N,N-diethyl-1-piperidin-1-ylpenta-1,3-dien-1-amine
CID 23267230
(2Z)-N,N-dimethyl-1-piperidin-1-ylpenta-2,4-dien-1-amine
CID 145592221

Frequently Asked Questions

What is the IUPAC name of (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine?
The IUPAC name of (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine (CID 134923532) is (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine.
What is the SMILES notation for (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine?
The canonical SMILES for (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine is C/C=C/C=C(/N(CCC)CCC)N1CCCCC1.
What is the InChIKey of (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine?
The InChIKey is ZPTOWYDWHUZIND-CHLGNXTCSA-N. The full InChI is InChI=1S/C16H30N2/c1-4-7-11-16(17(12-5-2)13-6-3)18-14-9-8-10-15-18/h4,7,11H,5-6,8-10,12-15H2,1-3H3/b7-4+,16-11-.
What are the key properties of (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine?
(1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine has a molecular weight of 250.43 g/mol, XLogP of 4.01, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E)-1-piperidin-1-yl-N,N-dipropylpenta-1,3-dien-1-amine is sourced from PubChem (CID 134923532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).