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

C9H13N — CID 143834497

IUPAC(2E)-3-methylidene-2-prop-2-enylidenepiperidine
SMILESC=C/C=C1/NCCCC1=C
InChIInChI=1S/C9H13N/c1-3-5-9-8(2)6-4-7-10-9/h3,5,10H,1-2,4,6-7H2/b9-5+
InChIKeyJJEWWDHKSWDCFT-WEVVVXLNSA-N
MW135.21 g/mol
LogP2.00
Rot. Bonds1

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

(2E)-3-methylidene-2-prop-2-enylidenepiperidine (PubChem CID 143834497) has the molecular formula C9H13N and a molecular weight of 135.21 g/mol. Its IUPAC name is (2E)-3-methylidene-2-prop-2-enylidenepiperidine.

Molecular Properties

Compound Name(2E)-3-methylidene-2-prop-2-enylidenepiperidine
PubChem CID143834497
Molecular FormulaC9H13N
Molecular Weight135.21 g/mol
Exact Mass135.10
IUPAC Name(2E)-3-methylidene-2-prop-2-enylidenepiperidine
SMILESC=C/C=C1/NCCCC1=C
InChIInChI=1S/C9H13N/c1-3-5-9-8(2)6-4-7-10-9/h3,5,10H,1-2,4,6-7H2/b9-5+
InChIKeyJJEWWDHKSWDCFT-WEVVVXLNSA-N
XLogP2.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.21
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2E)-3-methylidene-2-prop-2-enylidenepiperidine?
The IUPAC name of (2E)-3-methylidene-2-prop-2-enylidenepiperidine (CID 143834497) is (2E)-3-methylidene-2-prop-2-enylidenepiperidine.
What is the SMILES notation for (2E)-3-methylidene-2-prop-2-enylidenepiperidine?
The canonical SMILES for (2E)-3-methylidene-2-prop-2-enylidenepiperidine is C=C/C=C1/NCCCC1=C.
What is the InChIKey of (2E)-3-methylidene-2-prop-2-enylidenepiperidine?
The InChIKey is JJEWWDHKSWDCFT-WEVVVXLNSA-N. The full InChI is InChI=1S/C9H13N/c1-3-5-9-8(2)6-4-7-10-9/h3,5,10H,1-2,4,6-7H2/b9-5+.
What are the key properties of (2E)-3-methylidene-2-prop-2-enylidenepiperidine?
(2E)-3-methylidene-2-prop-2-enylidenepiperidine has a molecular weight of 135.21 g/mol, XLogP of 2.00, 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-enylidenepiperidine is sourced from PubChem (CID 143834497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).