3-ethylidene-2-(2-methylbut-2-enylidene)pyridine

C12H15N — CID 90959337

IUPAC3-ethylidene-2-(2-methylbut-2-enylidene)pyridine
SMILESCC=C(C)C=c1ncccc1=CC
InChIInChI=1S/C12H15N/c1-4-10(3)9-12-11(5-2)7-6-8-13-12/h4-9H,1-3H3
InChIKeyLWQOAQAMNTXDMT-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.63
Rot. Bonds1

About 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine

3-ethylidene-2-(2-methylbut-2-enylidene)pyridine (PubChem CID 90959337) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine.

Molecular Properties

Compound Name3-ethylidene-2-(2-methylbut-2-enylidene)pyridine
PubChem CID90959337
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name3-ethylidene-2-(2-methylbut-2-enylidene)pyridine
SMILESCC=C(C)C=c1ncccc1=CC
InChIInChI=1S/C12H15N/c1-4-10(3)9-12-11(5-2)7-6-8-13-12/h4-9H,1-3H3
InChIKeyLWQOAQAMNTXDMT-UHFFFAOYSA-N
XLogP1.63
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2Z,3Z)-3-ethylidene-2-(3-methylpent-3-en-2-ylidene)pyridine
CID 134386433
(2E,3Z)-3-[(Z)-but-2-enylidene]-2-ethylidenepyridine
CID 130370242
(5Z,6Z)-5-ethylidene-6-[(E)-2-methylpent-2-enylidene]cyclohexa-1,3-diene
CID 162733287
ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyridine
CID 142972372
(2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine
CID 166972950
(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane
CID 123449612
(3Z)-3-[(E)-2-chlorobut-2-enylidene]-2-methylidenepyridine
CID 142246266
(2Z,3Z)-2-(1-ethoxypropylidene)-3-ethylidenepyridine
CID 142189103
ethane;(2E)-2-ethylidene-3-methylidenepyridine;prop-1-ene
CID 144833891
(2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine
CID 143288900
(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;(2Z,4Z)-hexa-2,4-diene;methane
CID 161028149
(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine
CID 144667223

Frequently Asked Questions

What is the IUPAC name of 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine?
The IUPAC name of 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine (CID 90959337) is 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine.
What is the SMILES notation for 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine?
The canonical SMILES for 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine is CC=C(C)C=c1ncccc1=CC.
What is the InChIKey of 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine?
The InChIKey is LWQOAQAMNTXDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-4-10(3)9-12-11(5-2)7-6-8-13-12/h4-9H,1-3H3.
What are the key properties of 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine?
3-ethylidene-2-(2-methylbut-2-enylidene)pyridine has a molecular weight of 173.26 g/mol, XLogP of 1.63, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylidene-2-(2-methylbut-2-enylidene)pyridine is sourced from PubChem (CID 90959337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).