(2E)-3-methylidene-2-prop-2-enylidenepyrrolidine

C8H11N — CID 142354700

IUPAC(2E)-3-methylidene-2-prop-2-enylidenepyrrolidine
SMILESC=C/C=C1/NCCC1=C
InChIInChI=1S/C8H11N/c1-3-4-8-7(2)5-6-9-8/h3-4,9H,1-2,5-6H2/b8-4+
InChIKeyLKGMVEYOCCZFKQ-XBXARRHUSA-N
MW121.18 g/mol
LogP1.61
Rot. Bonds1

About (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine

(2E)-3-methylidene-2-prop-2-enylidenepyrrolidine (PubChem CID 142354700) has the molecular formula C8H11N and a molecular weight of 121.18 g/mol. Its IUPAC name is (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine.

Molecular Properties

Compound Name(2E)-3-methylidene-2-prop-2-enylidenepyrrolidine
PubChem CID142354700
Molecular FormulaC8H11N
Molecular Weight121.18 g/mol
Exact Mass121.09
IUPAC Name(2E)-3-methylidene-2-prop-2-enylidenepyrrolidine
SMILESC=C/C=C1/NCCC1=C
InChIInChI=1S/C8H11N/c1-3-4-8-7(2)5-6-9-8/h3-4,9H,1-2,5-6H2/b8-4+
InChIKeyLKGMVEYOCCZFKQ-XBXARRHUSA-N
XLogP1.61
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.18
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Tetrahydroindenoindole
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Dihydroindeno[1,2-b]pyridine
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N-[(Z)-5-fluorohex-3-enyl]-4-methylcyclopenta-1,3-dien-1-amine
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(3Z,5E)-5-fluoro-2,7,9,10-tetrahydro-1H-1-benzazonine
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N-[(4-fluorocyclohexa-1,5-dien-1-yl)methyl]buta-1,3-dien-2-amine
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Frequently Asked Questions

What is the IUPAC name of (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine?
The IUPAC name of (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine (CID 142354700) is (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine.
What is the SMILES notation for (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine?
The canonical SMILES for (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine is C=C/C=C1/NCCC1=C.
What is the InChIKey of (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine?
The InChIKey is LKGMVEYOCCZFKQ-XBXARRHUSA-N. The full InChI is InChI=1S/C8H11N/c1-3-4-8-7(2)5-6-9-8/h3-4,9H,1-2,5-6H2/b8-4+.
What are the key properties of (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine?
(2E)-3-methylidene-2-prop-2-enylidenepyrrolidine has a molecular weight of 121.18 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-3-methylidene-2-prop-2-enylidenepyrrolidine is sourced from PubChem (CID 142354700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).