2,5-bis(pyrrolidin-1-ylmethyl)pyridine

C15H23N3 — CID 127044984

IUPAC2,5-bis(pyrrolidin-1-ylmethyl)pyridine
SMILESc1cc(CN2CCCC2)ncc1CN1CCCC1
InChIInChI=1S/C15H23N3/c1-2-8-17(7-1)12-14-5-6-15(16-11-14)13-18-9-3-4-10-18/h5-6,11H,1-4,7-10,12-13H2
InChIKeyONMKRXAADKSKIL-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.27
Rot. Bonds4

About 2,5-bis(pyrrolidin-1-ylmethyl)pyridine

2,5-bis(pyrrolidin-1-ylmethyl)pyridine (PubChem CID 127044984) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 2,5-bis(pyrrolidin-1-ylmethyl)pyridine.

Molecular Properties

Compound Name2,5-bis(pyrrolidin-1-ylmethyl)pyridine
PubChem CID127044984
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name2,5-bis(pyrrolidin-1-ylmethyl)pyridine
SMILESc1cc(CN2CCCC2)ncc1CN1CCCC1
InChIInChI=1S/C15H23N3/c1-2-8-17(7-1)12-14-5-6-15(16-11-14)13-18-9-3-4-10-18/h5-6,11H,1-4,7-10,12-13H2
InChIKeyONMKRXAADKSKIL-UHFFFAOYSA-N
XLogP2.27
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(pyrrolidin-1-ylmethyl)pyridine?
The IUPAC name of 2,5-bis(pyrrolidin-1-ylmethyl)pyridine (CID 127044984) is 2,5-bis(pyrrolidin-1-ylmethyl)pyridine.
What is the SMILES notation for 2,5-bis(pyrrolidin-1-ylmethyl)pyridine?
The canonical SMILES for 2,5-bis(pyrrolidin-1-ylmethyl)pyridine is c1cc(CN2CCCC2)ncc1CN1CCCC1.
What is the InChIKey of 2,5-bis(pyrrolidin-1-ylmethyl)pyridine?
The InChIKey is ONMKRXAADKSKIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-2-8-17(7-1)12-14-5-6-15(16-11-14)13-18-9-3-4-10-18/h5-6,11H,1-4,7-10,12-13H2.
What are the key properties of 2,5-bis(pyrrolidin-1-ylmethyl)pyridine?
2,5-bis(pyrrolidin-1-ylmethyl)pyridine has a molecular weight of 245.37 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(pyrrolidin-1-ylmethyl)pyridine is sourced from PubChem (CID 127044984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).