(3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine

C10H10IN — CID 89155515

IUPAC(3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine
SMILESC/C=c1/cncc/c1=C/C=C/I
InChIInChI=1S/C10H10IN/c1-2-9-8-12-7-5-10(9)4-3-6-11/h2-8H,1H3/b6-3+,9-2-,10-4-
InChIKeyRSNHUDSSMQLLIZ-RRFIKNMXSA-N
MW271.10 g/mol
LogP1.61
Rot. Bonds1

About (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine

(3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine (PubChem CID 89155515) has the molecular formula C10H10IN and a molecular weight of 271.10 g/mol. Its IUPAC name is (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine.

Molecular Properties

Compound Name(3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine
PubChem CID89155515
Molecular FormulaC10H10IN
Molecular Weight271.10 g/mol
Exact Mass270.99
IUPAC Name(3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine
SMILESC/C=c1/cncc/c1=C/C=C/I
InChIInChI=1S/C10H10IN/c1-2-9-8-12-7-5-10(9)4-3-6-11/h2-8H,1H3/b6-3+,9-2-,10-4-
InChIKeyRSNHUDSSMQLLIZ-RRFIKNMXSA-N
XLogP1.61
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.10
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine?
The IUPAC name of (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine (CID 89155515) is (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine.
What is the SMILES notation for (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine?
The canonical SMILES for (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine is C/C=c1/cncc/c1=C/C=C/I.
What is the InChIKey of (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine?
The InChIKey is RSNHUDSSMQLLIZ-RRFIKNMXSA-N. The full InChI is InChI=1S/C10H10IN/c1-2-9-8-12-7-5-10(9)4-3-6-11/h2-8H,1H3/b6-3+,9-2-,10-4-.
What are the key properties of (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine?
(3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine has a molecular weight of 271.10 g/mol, XLogP of 1.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,4Z)-3-ethylidene-4-[(E)-3-iodoprop-2-enylidene]pyridine is sourced from PubChem (CID 89155515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).