1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine

C19H29N — CID 70420842

IUPAC1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine
SMILESC=CCN1CCC(CC=C)(CC=C)C1(CC=C)CC=C
InChIInChI=1S/C19H29N/c1-6-11-18(12-7-2)15-17-20(16-10-5)19(18,13-8-3)14-9-4/h6-10H,1-5,11-17H2
InChIKeyNRTKYUYELLWXFS-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.91
Rot. Bonds10

About 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine

1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine (PubChem CID 70420842) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine.

Molecular Properties

Compound Name1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine
PubChem CID70420842
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC Name1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine
SMILESC=CCN1CCC(CC=C)(CC=C)C1(CC=C)CC=C
InChIInChI=1S/C19H29N/c1-6-11-18(12-7-2)15-17-20(16-10-5)19(18,13-8-3)14-9-4/h6-10H,1-5,11-17H2
InChIKeyNRTKYUYELLWXFS-UHFFFAOYSA-N
XLogP4.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine?
The IUPAC name of 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine (CID 70420842) is 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine.
What is the SMILES notation for 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine?
The canonical SMILES for 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine is C=CCN1CCC(CC=C)(CC=C)C1(CC=C)CC=C.
What is the InChIKey of 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine?
The InChIKey is NRTKYUYELLWXFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-6-11-18(12-7-2)15-17-20(16-10-5)19(18,13-8-3)14-9-4/h6-10H,1-5,11-17H2.
What are the key properties of 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine?
1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine has a molecular weight of 271.45 g/mol, XLogP of 4.91, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,3,3-pentakis(prop-2-enyl)pyrrolidine is sourced from PubChem (CID 70420842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).