2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine

C15H23N3 — CID 74234895

IUPAC2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine
SMILESCc1cccc(CN2CCC(N3CCCC3)C2)n1
InChIInChI=1S/C15H23N3/c1-13-5-4-6-14(16-13)11-17-10-7-15(12-17)18-8-2-3-9-18/h4-6,15H,2-3,7-12H2,1H3
InChIKeyAKEJUTKSCGKCMM-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.06
Rot. Bonds3

About 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine

2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine (PubChem CID 74234895) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine
PubChem CID74234895
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine
SMILESCc1cccc(CN2CCC(N3CCCC3)C2)n1
InChIInChI=1S/C15H23N3/c1-13-5-4-6-14(16-13)11-17-10-7-15(12-17)18-8-2-3-9-18/h4-6,15H,2-3,7-12H2,1H3
InChIKeyAKEJUTKSCGKCMM-UHFFFAOYSA-N
XLogP2.06
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine
CID 79037923
[6-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]-2-pyridinyl]hydrazine
CID 79233890
1-(2-fluorophenyl)-4-[(3S)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]piperazine
CID 51635907
1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
CID 11160034
4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
CID 79260870
N-[[1-[(6-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methyl]propan-2-amine
CID 62512311
1-[(6-methyl-2-pyridinyl)methyl]piperidine-3,4-dicarboxylic acid
CID 115918772
N-methyl-1-[1-[(6-methyl-2-pyridinyl)methyl]piperidin-4-yl]-N-propan-2-ylpiperidine-4-carboxamide
CID 29153099
3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepane
CID 64948769
[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]-[1-[1-[(6-methyl-2-pyridinyl)methyl]piperidin-4-yl]piperidin-4-yl]methanone
CID 45228254
methyl 2-[methyl-[1-[1-[(6-methyl-2-pyridinyl)methyl]piperidin-4-yl]piperidine-4-carbonyl]amino]acetate
CID 42567842
(3R)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperazine
CID 104975601

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine?
The IUPAC name of 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine (CID 74234895) is 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine.
What is the SMILES notation for 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine?
The canonical SMILES for 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine is Cc1cccc(CN2CCC(N3CCCC3)C2)n1.
What is the InChIKey of 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine?
The InChIKey is AKEJUTKSCGKCMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-13-5-4-6-14(16-13)11-17-10-7-15(12-17)18-8-2-3-9-18/h4-6,15H,2-3,7-12H2,1H3.
What are the key properties of 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine?
2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine has a molecular weight of 245.37 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine is sourced from PubChem (CID 74234895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).