(5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine

C14H22N2 — CID 177389521

IUPAC(5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine
SMILESC=C1N/C(=C/C2=NCCC2(C)C)CC1(C)C
InChIInChI=1S/C14H22N2/c1-10-14(4,5)9-11(16-10)8-12-13(2,3)6-7-15-12/h8,16H,1,6-7,9H2,2-5H3/b11-8+
InChIKeyCGPZZKYRPFBWGP-DHZHZOJOSA-N
MW218.34 g/mol
LogP3.27
Rot. Bonds1

About (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine

(5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine (PubChem CID 177389521) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine.

Molecular Properties

Compound Name(5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine
PubChem CID177389521
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name(5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine
SMILESC=C1N/C(=C/C2=NCCC2(C)C)CC1(C)C
InChIInChI=1S/C14H22N2/c1-10-14(4,5)9-11(16-10)8-12-13(2,3)6-7-15-12/h8,16H,1,6-7,9H2,2-5H3/b11-8+
InChIKeyCGPZZKYRPFBWGP-DHZHZOJOSA-N
XLogP3.27
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine with MolForge

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Related Compounds

Cyclohex-1-ene, 1-ethylamino-3-ethylimino-5,5-dimethyl-
CID 130849495
Pyrrolidine, 4,4-dimethyl-2-(4,4,5-trimethyl-1-pyrrolin-2-yl)methylene-
CID 171384716
5-(3,3-Dimethyl-1,3-dihydropyrrol-2-ylidenemethyl)-2,3,3-trimethyl-3,4-dihydro-2H-pyrrole-2-carbonitrile
CID 5375639
5-(4,5-Dihydro-3H-pyrrol-2-ylmethylene)-4,4-dimethylpyrrolidine-2-thione
CID 5375878
1,3,3-Trimethyl-2-[(1,4,4-trimethyl-2,3-dihydropyrrol-1-ium-5-yl)methylidene]pyrrolidine
CID 59941725
2-(3,4-dihydro-2H-pyrrol-1-ium-5-ylmethylidene)pyrrolidine
CID 60077816
2-(Pyrrolidin-2-ylidenemethyl)-1-Pyrroline
CID 60077817
5-[(E)-pyrrolidin-2-ylidenemethyl]-3,4-dihydro-2H-pyrrole
CID 68988836
ethane;fluoromethane;(E)-4-methylimino-4-pyrrolidin-3-ylbut-2-en-2-amine;propane
CID 144740190
(2E)-4,4-diethyl-2-ethylidene-N-methylpyrrolidin-3-imine
CID 170606240
1-(5,5-Dimethyl-3-pyrrolidin-1-ium-1-ylcyclohex-2-en-1-ylidene)pyrrolidin-1-ium
CID 2308083
1-[3-(Aziridin-1-ium-1-yl)-5,5-dimethylcyclohex-2-en-1-ylidene]pyrrolidin-1-ium
CID 2314670

Frequently Asked Questions

What is the IUPAC name of (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine?
The IUPAC name of (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine (CID 177389521) is (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine.
What is the SMILES notation for (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine?
The canonical SMILES for (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine is C=C1N/C(=C/C2=NCCC2(C)C)CC1(C)C.
What is the InChIKey of (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine?
The InChIKey is CGPZZKYRPFBWGP-DHZHZOJOSA-N. The full InChI is InChI=1S/C14H22N2/c1-10-14(4,5)9-11(16-10)8-12-13(2,3)6-7-15-12/h8,16H,1,6-7,9H2,2-5H3/b11-8+.
What are the key properties of (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine?
(5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine has a molecular weight of 218.34 g/mol, XLogP of 3.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-[(4,4-dimethyl-2,3-dihydropyrrol-5-yl)methylidene]-3,3-dimethyl-2-methylidenepyrrolidine is sourced from PubChem (CID 177389521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).