2-[(3Z)-penta-1,3-dien-3-yl]pyridine

C10H11N — CID 147592446

IUPAC2-[(3Z)-penta-1,3-dien-3-yl]pyridine
SMILESC=C/C(=C/C)c1ccccn1
InChIInChI=1S/C10H11N/c1-3-9(4-2)10-7-5-6-8-11-10/h3-8H,1H2,2H3/b9-4-
InChIKeyFYNXFURVWBOIKG-WTKPLQERSA-N
MW145.20 g/mol
LogP2.67
Rot. Bonds2

About 2-[(3Z)-penta-1,3-dien-3-yl]pyridine

2-[(3Z)-penta-1,3-dien-3-yl]pyridine (PubChem CID 147592446) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 2-[(3Z)-penta-1,3-dien-3-yl]pyridine.

Molecular Properties

Compound Name2-[(3Z)-penta-1,3-dien-3-yl]pyridine
PubChem CID147592446
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name2-[(3Z)-penta-1,3-dien-3-yl]pyridine
SMILESC=C/C(=C/C)c1ccccn1
InChIInChI=1S/C10H11N/c1-3-9(4-2)10-7-5-6-8-11-10/h3-8H,1H2,2H3/b9-4-
InChIKeyFYNXFURVWBOIKG-WTKPLQERSA-N
XLogP2.67
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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ethane;2-[(2Z,4E)-hepta-2,4-dien-4-yl]pyridine
CID 145320713
2-[(3E,5Z)-2-phenylhepta-1,3,5-trien-4-yl]pyridine
CID 139420658
(3Z,5Z,7E)-3-methyl-7-pyridin-2-ylnona-3,5,7-trien-4-amine
CID 142517601
(Z,Z)-2-pyridin-2-yl-N-[1-(pyridin-2-ylmethoxy)ethenyl]but-2-en-1-imine
CID 142517593
2-[(Z)-3-buta-1,3-dien-2-ylsulfanylbut-2-en-2-yl]pyridine
CID 155095870
(Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine
CID 144731406
2-(3-methylbuta-1,3-dien-2-yl)pyridine
CID 91495924
2-[(Z)-pent-2-en-2-yl]pyridine
CID 45079825
2-(1-ethenylsulfanylethenyl)pyridine
CID 143276726
(Z,Z)-2-pyridin-2-yl-N-[1-(1-pyridin-2-ylethoxy)ethenyl]but-2-en-1-imine
CID 142517548

Frequently Asked Questions

What is the IUPAC name of 2-[(3Z)-penta-1,3-dien-3-yl]pyridine?
The IUPAC name of 2-[(3Z)-penta-1,3-dien-3-yl]pyridine (CID 147592446) is 2-[(3Z)-penta-1,3-dien-3-yl]pyridine.
What is the SMILES notation for 2-[(3Z)-penta-1,3-dien-3-yl]pyridine?
The canonical SMILES for 2-[(3Z)-penta-1,3-dien-3-yl]pyridine is C=C/C(=C/C)c1ccccn1.
What is the InChIKey of 2-[(3Z)-penta-1,3-dien-3-yl]pyridine?
The InChIKey is FYNXFURVWBOIKG-WTKPLQERSA-N. The full InChI is InChI=1S/C10H11N/c1-3-9(4-2)10-7-5-6-8-11-10/h3-8H,1H2,2H3/b9-4-.
What are the key properties of 2-[(3Z)-penta-1,3-dien-3-yl]pyridine?
2-[(3Z)-penta-1,3-dien-3-yl]pyridine has a molecular weight of 145.20 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3Z)-penta-1,3-dien-3-yl]pyridine is sourced from PubChem (CID 147592446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).