(2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine

C12H20N2 — CID 142139228

IUPAC(2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine
SMILESC=C/C=C(\C)NC(=C)C1CCNCC1
InChIInChI=1S/C12H20N2/c1-4-5-10(2)14-11(3)12-6-8-13-9-7-12/h4-5,12-14H,1,3,6-9H2,2H3/b10-5+
InChIKeyFDJFHXRJXHJAPE-BJMVGYQFSA-N
MW192.31 g/mol
LogP2.18
Rot. Bonds4

About (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine

(2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine (PubChem CID 142139228) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine.

Molecular Properties

Compound Name(2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine
PubChem CID142139228
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name(2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine
SMILESC=C/C=C(\C)NC(=C)C1CCNCC1
InChIInChI=1S/C12H20N2/c1-4-5-10(2)14-11(3)12-6-8-13-9-7-12/h4-5,12-14H,1,3,6-9H2,2H3/b10-5+
InChIKeyFDJFHXRJXHJAPE-BJMVGYQFSA-N
XLogP2.18
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-hexa-1,3,5-trien-3-ylpiperidine-4-carboxamide
CID 123538587
4-[(Z)-1-fluoroprop-1-en-2-yl]piperidine
CID 174359173
4-[(E)-but-2-en-2-yl]piperidine
CID 134286079
4-prop-1-en-2-ylazepane
CID 83262018
N-methyl-3-piperidin-4-ylbut-3-en-1-amine
CID 117268270
4-[(3E)-8-methylnona-1,3-dien-4-yl]piperidine
CID 155373344
ethane;4-[(2Z,4Z)-hepta-2,4,6-trien-3-yl]piperidine
CID 142942953
1-piperidin-4-ylethanone
CID 2723764
(3E,5Z)-N-[(2E)-penta-2,4-dien-2-yl]hepta-1,3,5-trien-3-amine
CID 143745515
(3E)-4-methylhexa-1,3-diene;2-piperidin-4-ylethanamine
CID 162737186
4-methyl-1-piperidin-4-ylpent-4-en-1-one
CID 114477846
4-[(E)-but-2-en-2-yl]-1-(1-piperidin-4-ylethenyl)piperidine
CID 178093909

Frequently Asked Questions

What is the IUPAC name of (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine?
The IUPAC name of (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine (CID 142139228) is (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine.
What is the SMILES notation for (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine?
The canonical SMILES for (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine is C=C/C=C(\C)NC(=C)C1CCNCC1.
What is the InChIKey of (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine?
The InChIKey is FDJFHXRJXHJAPE-BJMVGYQFSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-5-10(2)14-11(3)12-6-8-13-9-7-12/h4-5,12-14H,1,3,6-9H2,2H3/b10-5+.
What are the key properties of (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine?
(2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine has a molecular weight of 192.31 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N-(1-piperidin-4-ylethenyl)penta-2,4-dien-2-amine is sourced from PubChem (CID 142139228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).