2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine

C15H19N3 — CID 4280984

IUPAC2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine
SMILESCc1cccc(-n2cccc2CN2CCCC2)n1
InChIInChI=1S/C15H19N3/c1-13-6-4-8-15(16-13)18-11-5-7-14(18)12-17-9-2-3-10-17/h4-8,11H,2-3,9-10,12H2,1H3
InChIKeyKIRDPVBJAYKVIP-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.78
Rot. Bonds3

About 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine

2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine (PubChem CID 4280984) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine.

Molecular Properties

Compound Name2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine
PubChem CID4280984
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine
SMILESCc1cccc(-n2cccc2CN2CCCC2)n1
InChIInChI=1S/C15H19N3/c1-13-6-4-8-15(16-13)18-11-5-7-14(18)12-17-9-2-3-10-17/h4-8,11H,2-3,9-10,12H2,1H3
InChIKeyKIRDPVBJAYKVIP-UHFFFAOYSA-N
XLogP2.78
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine?
The IUPAC name of 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine (CID 4280984) is 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine.
What is the SMILES notation for 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine?
The canonical SMILES for 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine is Cc1cccc(-n2cccc2CN2CCCC2)n1.
What is the InChIKey of 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine?
The InChIKey is KIRDPVBJAYKVIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-13-6-4-8-15(16-13)18-11-5-7-14(18)12-17-9-2-3-10-17/h4-8,11H,2-3,9-10,12H2,1H3.
What are the key properties of 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine?
2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine has a molecular weight of 241.34 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)pyrrol-1-yl]pyridine is sourced from PubChem (CID 4280984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).