4-[(2-methylpyrrolidin-2-yl)methyl]pyridine

C11H16N2 — CID 66465987

IUPAC4-[(2-methylpyrrolidin-2-yl)methyl]pyridine
SMILESCC1(Cc2ccncc2)CCCN1
InChIInChI=1S/C11H16N2/c1-11(5-2-6-13-11)9-10-3-7-12-8-4-10/h3-4,7-8,13H,2,5-6,9H2,1H3
InChIKeyDSLDVIGXKQGDGW-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.77
Rot. Bonds2

About 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine

4-[(2-methylpyrrolidin-2-yl)methyl]pyridine (PubChem CID 66465987) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine.

Molecular Properties

Compound Name4-[(2-methylpyrrolidin-2-yl)methyl]pyridine
PubChem CID66465987
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name4-[(2-methylpyrrolidin-2-yl)methyl]pyridine
SMILESCC1(Cc2ccncc2)CCCN1
InChIInChI=1S/C11H16N2/c1-11(5-2-6-13-11)9-10-3-7-12-8-4-10/h3-4,7-8,13H,2,5-6,9H2,1H3
InChIKeyDSLDVIGXKQGDGW-UHFFFAOYSA-N
XLogP1.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine?
The IUPAC name of 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine (CID 66465987) is 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine.
What is the SMILES notation for 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine?
The canonical SMILES for 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine is CC1(Cc2ccncc2)CCCN1.
What is the InChIKey of 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine?
The InChIKey is DSLDVIGXKQGDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-11(5-2-6-13-11)9-10-3-7-12-8-4-10/h3-4,7-8,13H,2,5-6,9H2,1H3.
What are the key properties of 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine?
4-[(2-methylpyrrolidin-2-yl)methyl]pyridine has a molecular weight of 176.26 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylpyrrolidin-2-yl)methyl]pyridine is sourced from PubChem (CID 66465987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).