1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine

C18H27N3 — CID 13203614

IUPAC1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine
SMILESc1c(N2CCCC2)cc(N2CCCC2)cc1N1CCCC1
InChIInChI=1S/C18H27N3/c1-2-8-19(7-1)16-13-17(20-9-3-4-10-20)15-18(14-16)21-11-5-6-12-21/h13-15H,1-12H2
InChIKeySFVZVBHRZXWPGQ-UHFFFAOYSA-N
MW285.43 g/mol
LogP3.49
Rot. Bonds3

About 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine

1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine (PubChem CID 13203614) has the molecular formula C18H27N3 and a molecular weight of 285.43 g/mol. Its IUPAC name is 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine.

Molecular Properties

Compound Name1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine
PubChem CID13203614
Molecular FormulaC18H27N3
Molecular Weight285.43 g/mol
Exact Mass285.22
IUPAC Name1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine
SMILESc1c(N2CCCC2)cc(N2CCCC2)cc1N1CCCC1
InChIInChI=1S/C18H27N3/c1-2-8-19(7-1)16-13-17(20-9-3-4-10-20)15-18(14-16)21-11-5-6-12-21/h13-15H,1-12H2
InChIKeySFVZVBHRZXWPGQ-UHFFFAOYSA-N
XLogP3.49
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine?
The IUPAC name of 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine (CID 13203614) is 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine.
What is the SMILES notation for 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine?
The canonical SMILES for 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine is c1c(N2CCCC2)cc(N2CCCC2)cc1N1CCCC1.
What is the InChIKey of 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine?
The InChIKey is SFVZVBHRZXWPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3/c1-2-8-19(7-1)16-13-17(20-9-3-4-10-20)15-18(14-16)21-11-5-6-12-21/h13-15H,1-12H2.
What are the key properties of 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine?
1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine has a molecular weight of 285.43 g/mol, XLogP of 3.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine is sourced from PubChem (CID 13203614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).