1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine

C10H18N2 — CID 11768925

IUPAC1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine
SMILESCN1CC=C(N2CCCC2)CC1
InChIInChI=1S/C10H18N2/c1-11-8-4-10(5-9-11)12-6-2-3-7-12/h4H,2-3,5-9H2,1H3
InChIKeyQLMRTUAJAFAJAD-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.30
Rot. Bonds1

About 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine

1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine (PubChem CID 11768925) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine
PubChem CID11768925
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine
SMILESCN1CC=C(N2CCCC2)CC1
InChIInChI=1S/C10H18N2/c1-11-8-4-10(5-9-11)12-6-2-3-7-12/h4H,2-3,5-9H2,1H3
InChIKeyQLMRTUAJAFAJAD-UHFFFAOYSA-N
XLogP1.30
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine?
The IUPAC name of 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine (CID 11768925) is 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine is CN1CC=C(N2CCCC2)CC1.
What is the InChIKey of 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine?
The InChIKey is QLMRTUAJAFAJAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-11-8-4-10(5-9-11)12-6-2-3-7-12/h4H,2-3,5-9H2,1H3.
What are the key properties of 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine?
1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine has a molecular weight of 166.27 g/mol, XLogP of 1.30, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 11768925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).