1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine

C11H13N — CID 91319769

IUPAC1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine
SMILESC=CN1C=CC(=CC)C(=C)C1=C
InChIInChI=1S/C11H13N/c1-5-11-7-8-12(6-2)10(4)9(11)3/h5-8H,2-4H2,1H3
InChIKeyNVYSRECRRJTMPO-UHFFFAOYSA-N
MW159.23 g/mol
LogP2.98
Rot. Bonds1

About 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine

1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine (PubChem CID 91319769) has the molecular formula C11H13N and a molecular weight of 159.23 g/mol. Its IUPAC name is 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine.

Molecular Properties

Compound Name1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine
PubChem CID91319769
Molecular FormulaC11H13N
Molecular Weight159.23 g/mol
Exact Mass159.10
IUPAC Name1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine
SMILESC=CN1C=CC(=CC)C(=C)C1=C
InChIInChI=1S/C11H13N/c1-5-11-7-8-12(6-2)10(4)9(11)3/h5-8H,2-4H2,1H3
InChIKeyNVYSRECRRJTMPO-UHFFFAOYSA-N
XLogP2.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine?
The IUPAC name of 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine (CID 91319769) is 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine.
What is the SMILES notation for 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine?
The canonical SMILES for 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine is C=CN1C=CC(=CC)C(=C)C1=C.
What is the InChIKey of 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine?
The InChIKey is NVYSRECRRJTMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N/c1-5-11-7-8-12(6-2)10(4)9(11)3/h5-8H,2-4H2,1H3.
What are the key properties of 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine?
1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine has a molecular weight of 159.23 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-ethylidene-2,3-dimethylidenepyridine is sourced from PubChem (CID 91319769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).