(5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine

C10H13N — CID 89200020

IUPAC(5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine
SMILESC=C/C=C1/CCC=N/C1=C/C
InChIInChI=1S/C10H13N/c1-3-6-9-7-5-8-11-10(9)4-2/h3-4,6,8H,1,5,7H2,2H3/b9-6-,10-4+
InChIKeyYZPZZZDYZAZSIS-WFNCLBMMSA-N
MW147.22 g/mol
LogP2.87
Rot. Bonds1

About (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine

(5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine (PubChem CID 89200020) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine.

Molecular Properties

Compound Name(5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine
PubChem CID89200020
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name(5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine
SMILESC=C/C=C1/CCC=N/C1=C/C
InChIInChI=1S/C10H13N/c1-3-6-9-7-5-8-11-10(9)4-2/h3-4,6,8H,1,5,7H2,2H3/b9-6-,10-4+
InChIKeyYZPZZZDYZAZSIS-WFNCLBMMSA-N
XLogP2.87
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine?
The IUPAC name of (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine (CID 89200020) is (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine.
What is the SMILES notation for (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine?
The canonical SMILES for (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine is C=C/C=C1/CCC=N/C1=C/C.
What is the InChIKey of (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine?
The InChIKey is YZPZZZDYZAZSIS-WFNCLBMMSA-N. The full InChI is InChI=1S/C10H13N/c1-3-6-9-7-5-8-11-10(9)4-2/h3-4,6,8H,1,5,7H2,2H3/b9-6-,10-4+.
What are the key properties of (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine?
(5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine has a molecular weight of 147.22 g/mol, XLogP of 2.87, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine is sourced from PubChem (CID 89200020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).