(Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine

C13H24N2 — CID 145007831

IUPAC(Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine
SMILESC/C=C(\C=C/CN1CCCC1)CN(C)C
InChIInChI=1S/C13H24N2/c1-4-13(12-14(2)3)8-7-11-15-9-5-6-10-15/h4,7-8H,5-6,9-12H2,1-3H3/b8-7-,13-4+
InChIKeyRTGOIQLVRIWNPF-MUMAOQJLSA-N
MW208.35 g/mol
LogP2.15
Rot. Bonds5

About (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine

(Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine (PubChem CID 145007831) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine.

Molecular Properties

Compound Name(Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine
PubChem CID145007831
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name(Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine
SMILESC/C=C(\C=C/CN1CCCC1)CN(C)C
InChIInChI=1S/C13H24N2/c1-4-13(12-14(2)3)8-7-11-15-9-5-6-10-15/h4,7-8H,5-6,9-12H2,1-3H3/b8-7-,13-4+
InChIKeyRTGOIQLVRIWNPF-MUMAOQJLSA-N
XLogP2.15
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine?
The IUPAC name of (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine (CID 145007831) is (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine.
What is the SMILES notation for (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine?
The canonical SMILES for (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine is C/C=C(\C=C/CN1CCCC1)CN(C)C.
What is the InChIKey of (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine?
The InChIKey is RTGOIQLVRIWNPF-MUMAOQJLSA-N. The full InChI is InChI=1S/C13H24N2/c1-4-13(12-14(2)3)8-7-11-15-9-5-6-10-15/h4,7-8H,5-6,9-12H2,1-3H3/b8-7-,13-4+.
What are the key properties of (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine?
(Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine has a molecular weight of 208.35 g/mol, XLogP of 2.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2E)-2-ethylidene-N,N-dimethyl-5-pyrrolidin-1-ylpent-3-en-1-amine is sourced from PubChem (CID 145007831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).