4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine

C15H23N3 — CID 63257496

IUPAC4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine
SMILESCc1ccnc(N2CCC(C3CCCN3)CC2)c1
InChIInChI=1S/C15H23N3/c1-12-4-8-17-15(11-12)18-9-5-13(6-10-18)14-3-2-7-16-14/h4,8,11,13-14,16H,2-3,5-7,9-10H2,1H3
InChIKeyUGXUJEHOGOTPOI-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.36
Rot. Bonds2

About 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine

4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine (PubChem CID 63257496) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine.

Molecular Properties

Compound Name4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine
PubChem CID63257496
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine
SMILESCc1ccnc(N2CCC(C3CCCN3)CC2)c1
InChIInChI=1S/C15H23N3/c1-12-4-8-17-15(11-12)18-9-5-13(6-10-18)14-3-2-7-16-14/h4,8,11,13-14,16H,2-3,5-7,9-10H2,1H3
InChIKeyUGXUJEHOGOTPOI-UHFFFAOYSA-N
XLogP2.36
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine?
The IUPAC name of 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine (CID 63257496) is 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine.
What is the SMILES notation for 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine?
The canonical SMILES for 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine is Cc1ccnc(N2CCC(C3CCCN3)CC2)c1.
What is the InChIKey of 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine?
The InChIKey is UGXUJEHOGOTPOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-12-4-8-17-15(11-12)18-9-5-13(6-10-18)14-3-2-7-16-14/h4,8,11,13-14,16H,2-3,5-7,9-10H2,1H3.
What are the key properties of 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine?
4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine has a molecular weight of 245.37 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine is sourced from PubChem (CID 63257496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).