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

C15H23N3 — CID 112650958

IUPAC3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine
SMILESCc1cccnc1CN1CCCC1C1CCCN1
InChIInChI=1S/C15H23N3/c1-12-5-2-8-17-14(12)11-18-10-4-7-15(18)13-6-3-9-16-13/h2,5,8,13,15-16H,3-4,6-7,9-11H2,1H3
InChIKeyUBKUKZCMGQXZTI-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.11
Rot. Bonds3

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

3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine (PubChem CID 112650958) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine.

Molecular Properties

Compound Name3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine
PubChem CID112650958
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine
SMILESCc1cccnc1CN1CCCC1C1CCCN1
InChIInChI=1S/C15H23N3/c1-12-5-2-8-17-14(12)11-18-10-4-7-15(18)13-6-3-9-16-13/h2,5,8,13,15-16H,3-4,6-7,9-11H2,1H3
InChIKeyUBKUKZCMGQXZTI-UHFFFAOYSA-N
XLogP2.11
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol
CID 114339826
[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 103897843
2-pyrrolidin-2-yl-1-[(2,4,5-trimethylphenyl)methyl]pyrrolidine
CID 104869393
1-[(2,5-dimethylphenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
CID 55054099
2-[[2-(3-chloropropyl)pyrrolidin-1-yl]methyl]-3-methylpyridine
CID 112651342
3-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxylic acid
CID 107072167
(2R)-1-benzyl-2-[(2R)-pyrrolidin-2-yl]piperidine
CID 124710332
1-[(2-methylpyrazol-3-yl)methyl]-2-pyrrolidin-2-ylpiperidine
CID 63256578
3-methyl-2-[[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]methyl]pyridine
CID 110106195
3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
CID 63262845
3-ethyl-1-[(3-methyl-2-pyridinyl)methyl]-1,4-diazepane
CID 64950792
1-[(3-methyl-2-pyridinyl)methyl]-1,5-diazocane
CID 63306542

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine?
The IUPAC name of 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine (CID 112650958) is 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine.
What is the SMILES notation for 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine?
The canonical SMILES for 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine is Cc1cccnc1CN1CCCC1C1CCCN1.
What is the InChIKey of 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine?
The InChIKey is UBKUKZCMGQXZTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-12-5-2-8-17-14(12)11-18-10-4-7-15(18)13-6-3-9-16-13/h2,5,8,13,15-16H,3-4,6-7,9-11H2,1H3.
What are the key properties of 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine?
3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine has a molecular weight of 245.37 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine is sourced from PubChem (CID 112650958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).