(3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine

C13H19N — CID 170363946

IUPAC(3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine
SMILESC=C/C=C1/C(=C)N(C(C)C)C/C1=C/C
InChIInChI=1S/C13H19N/c1-6-8-13-11(5)14(10(3)4)9-12(13)7-2/h6-8,10H,1,5,9H2,2-4H3/b12-7-,13-8-
InChIKeyHWWXFMQJNRDGRV-AJDRMPRJSA-N
MW189.30 g/mol
LogP3.28
Rot. Bonds2

About (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine

(3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine (PubChem CID 170363946) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine.

Molecular Properties

Compound Name(3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine
PubChem CID170363946
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name(3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine
SMILESC=C/C=C1/C(=C)N(C(C)C)C/C1=C/C
InChIInChI=1S/C13H19N/c1-6-8-13-11(5)14(10(3)4)9-12(13)7-2/h6-8,10H,1,5,9H2,2-4H3/b12-7-,13-8-
InChIKeyHWWXFMQJNRDGRV-AJDRMPRJSA-N
XLogP3.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;(5Z,6E)-5-ethylidene-1-propan-2-yl-6-prop-2-enylidene-1,3-diazinane;methane
CID 170785783
2-[(3E,4E)-4-ethylidene-2-oxo-3-prop-2-enylidenepyrrolidin-1-yl]-N-methyl-5-oxopentanamide
CID 170049159
2-ethylidene-3-prop-2-enylidenethiolane
CID 123580390
(3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine
CID 89468901
(3E)-3-[(Z)-but-2-enylidene]-4-methylidene-1-propan-2-ylpyrrolidin-2-one
CID 146527350
1-ethylidene-2-prop-2-enylidenecyclooctane
CID 91407681
3-ethylidene-4-prop-2-enylideneoxolane
CID 90927536
ethane;(3E,4E)-3-ethylidene-1-methyl-4-prop-2-enylidenepyrrolidin-2-one
CID 171627448
ethane;(1Z,2Z)-1-ethylidene-3-propan-2-yl-2-prop-2-enylidenecyclopentane
CID 157035822
ethane;(1Z,2Z)-1-ethylidene-2-prop-2-enylidenecycloheptane
CID 143924638
(4Z,5E)-2-tert-butyl-5-ethylidene-4-prop-2-enylidene-1,2-thiazolidine 1,1-dioxide
CID 130351968
(5Z,6E)-5-ethylidene-3,3-dimethyl-6-prop-2-enylideneazepane-2,7-dione
CID 146429611

Frequently Asked Questions

What is the IUPAC name of (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine?
The IUPAC name of (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine (CID 170363946) is (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine.
What is the SMILES notation for (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine?
The canonical SMILES for (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine is C=C/C=C1/C(=C)N(C(C)C)C/C1=C/C.
What is the InChIKey of (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine?
The InChIKey is HWWXFMQJNRDGRV-AJDRMPRJSA-N. The full InChI is InChI=1S/C13H19N/c1-6-8-13-11(5)14(10(3)4)9-12(13)7-2/h6-8,10H,1,5,9H2,2-4H3/b12-7-,13-8-.
What are the key properties of (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine?
(3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine has a molecular weight of 189.30 g/mol, XLogP of 3.28, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,4E)-4-ethylidene-2-methylidene-1-propan-2-yl-3-prop-2-enylidenepyrrolidine is sourced from PubChem (CID 170363946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).