(5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine

C15H22N2 — CID 10036847

IUPAC(5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine
SMILESC1=NCCC/C1=C\CCC/C=C1/C=NCCC1
InChIInChI=1S/C15H22N2/c1(2-6-14-8-4-10-16-12-14)3-7-15-9-5-11-17-13-15/h6-7,12-13H,1-5,8-11H2/b14-6+,15-7+
InChIKeyPLRJVKFUOXCVDV-MKFXEVHTSA-N
MW230.35 g/mol
LogP3.74
Rot. Bonds4

About (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine

(5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine (PubChem CID 10036847) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name(5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine
PubChem CID10036847
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name(5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine
SMILESC1=NCCC/C1=C\CCC/C=C1/C=NCCC1
InChIInChI=1S/C15H22N2/c1(2-6-14-8-4-10-16-12-14)3-7-15-9-5-11-17-13-15/h6-7,12-13H,1-5,8-11H2/b14-6+,15-7+
InChIKeyPLRJVKFUOXCVDV-MKFXEVHTSA-N
XLogP3.74
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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(5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-1-ium-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridin-1-ium
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CID 70267509
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CID 74047303
3,4,6,7-Tetrahydroisoquinoline
CID 89318540
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N-hexyl-2-propylpent-2-en-1-imine
CID 90856067

Frequently Asked Questions

What is the IUPAC name of (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine?
The IUPAC name of (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine (CID 10036847) is (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine.
What is the SMILES notation for (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine?
The canonical SMILES for (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine is C1=NCCC/C1=C\CCC/C=C1/C=NCCC1.
What is the InChIKey of (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine?
The InChIKey is PLRJVKFUOXCVDV-MKFXEVHTSA-N. The full InChI is InChI=1S/C15H22N2/c1(2-6-14-8-4-10-16-12-14)3-7-15-9-5-11-17-13-15/h6-7,12-13H,1-5,8-11H2/b14-6+,15-7+.
What are the key properties of (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine?
(5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine has a molecular weight of 230.35 g/mol, XLogP of 3.74, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-[(5E)-5-(3,4-dihydro-2H-pyridin-5-ylidene)pentylidene]-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 10036847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).