(3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine

C11H16N2 — CID 143969301

IUPAC(3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine
SMILESC=C/C=c1/cncc/c1=C/C.CN
InChIInChI=1S/C10H11N.CH5N/c1-3-5-10-8-11-7-6-9(10)4-2;1-2/h3-8H,1H2,2H3;2H2,1H3/b9-4-,10-5-;
InChIKeyOYRHTVHIXHTSNI-DRWVTRDWSA-N
MW176.26 g/mol
LogP0.42
Rot. Bonds1

About (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine

(3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine (PubChem CID 143969301) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine.

Molecular Properties

Compound Name(3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine
PubChem CID143969301
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name(3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine
SMILESC=C/C=c1/cncc/c1=C/C.CN
InChIInChI=1S/C10H11N.CH5N/c1-3-5-10-8-11-7-6-9(10)4-2;1-2/h3-8H,1H2,2H3;2H2,1H3/b9-4-,10-5-;
InChIKeyOYRHTVHIXHTSNI-DRWVTRDWSA-N
XLogP0.42
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine?
The IUPAC name of (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine (CID 143969301) is (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine.
What is the SMILES notation for (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine?
The canonical SMILES for (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine is C=C/C=c1/cncc/c1=C/C.CN.
What is the InChIKey of (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine?
The InChIKey is OYRHTVHIXHTSNI-DRWVTRDWSA-N. The full InChI is InChI=1S/C10H11N.CH5N/c1-3-5-10-8-11-7-6-9(10)4-2;1-2/h3-8H,1H2,2H3;2H2,1H3/b9-4-,10-5-;.
What are the key properties of (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine?
(3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine has a molecular weight of 176.26 g/mol, XLogP of 0.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,4Z)-4-ethylidene-3-prop-2-enylidenepyridine;methanamine is sourced from PubChem (CID 143969301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).