(2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine

C12H15N — CID 143288900

IUPAC(2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine
SMILESC=C/C=c1/nccc/c1=C/C(C)C
InChIInChI=1S/C12H15N/c1-4-6-12-11(9-10(2)3)7-5-8-13-12/h4-10H,1H2,2-3H3/b11-9-,12-6+
InChIKeyNHZDPNHDYMSKRL-AFUQHQPYSA-N
MW173.26 g/mol
LogP1.48
Rot. Bonds2

About (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine

(2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine (PubChem CID 143288900) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine.

Molecular Properties

Compound Name(2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine
PubChem CID143288900
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name(2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine
SMILESC=C/C=c1/nccc/c1=C/C(C)C
InChIInChI=1S/C12H15N/c1-4-6-12-11(9-10(2)3)7-5-8-13-12/h4-10H,1H2,2-3H3/b11-9-,12-6+
InChIKeyNHZDPNHDYMSKRL-AFUQHQPYSA-N
XLogP1.48
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyridine
CID 142972372
3-methylidene-2-prop-2-enylidenepyridine
CID 72652539
(2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine
CID 146427123
(2E,3Z)-3-[(Z)-but-2-enylidene]-2-ethylidenepyridine
CID 130370242
ethane;(2E)-2-ethylidene-3-methylidenepyridine;prop-1-ene
CID 144833891
(3E,4Z)-4-ethylidene-3-prop-2-enylideneisoquinoline
CID 143672117
buta-1,3-diene;2,3-dimethylpyridine;ethane
CID 145249818
prop-1-ene;quinoline
CID 159640565
7-methyl-8-propan-2-ylquinoline
CID 142451043
3-ethylidene-2-(2-methylbut-2-enylidene)pyridine
CID 90959337
(5Z,6Z)-5-prop-2-enylidene-6-[2-[5-(trifluoromethoxy)pentoxy]propylidene]cyclohexa-1,3-diene
CID 89300743
bis(2-methylpropane);quinoline
CID 159945466

Frequently Asked Questions

What is the IUPAC name of (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine?
The IUPAC name of (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine (CID 143288900) is (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine.
What is the SMILES notation for (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine?
The canonical SMILES for (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine is C=C/C=c1/nccc/c1=C/C(C)C.
What is the InChIKey of (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine?
The InChIKey is NHZDPNHDYMSKRL-AFUQHQPYSA-N. The full InChI is InChI=1S/C12H15N/c1-4-6-12-11(9-10(2)3)7-5-8-13-12/h4-10H,1H2,2-3H3/b11-9-,12-6+.
What are the key properties of (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine?
(2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine has a molecular weight of 173.26 g/mol, XLogP of 1.48, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3Z)-3-(2-methylpropylidene)-2-prop-2-enylidenepyridine is sourced from PubChem (CID 143288900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).