6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine

C16H26N2O — CID 134288593

IUPAC6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine
SMILESCN1CC(CCCN2CCCC2)=CC=C1OC1CC1
InChIInChI=1S/C16H26N2O/c1-17-13-14(5-4-12-18-10-2-3-11-18)6-9-16(17)19-15-7-8-15/h6,9,15H,2-5,7-8,10-13H2,1H3
InChIKeyTZKPLTVXCRKUOA-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.75
Rot. Bonds6

About 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine

6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine (PubChem CID 134288593) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine.

Molecular Properties

Compound Name6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine
PubChem CID134288593
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine
SMILESCN1CC(CCCN2CCCC2)=CC=C1OC1CC1
InChIInChI=1S/C16H26N2O/c1-17-13-14(5-4-12-18-10-2-3-11-18)6-9-16(17)19-15-7-8-15/h6,9,15H,2-5,7-8,10-13H2,1H3
InChIKeyTZKPLTVXCRKUOA-UHFFFAOYSA-N
XLogP2.75
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-(3-pyrrolidin-1-ylpropyl)-6-(2,2,2-trifluoroethoxy)-2H-pyridine
CID 134288437
6-Cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine
CID 134288453
(1E,3E)-4-methyl-1-propan-2-yloxy-7-pyrrolidin-1-ylhepta-1,3-dien-1-amine
CID 134288485

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine?
The IUPAC name of 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine (CID 134288593) is 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine.
What is the SMILES notation for 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine?
The canonical SMILES for 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine is CN1CC(CCCN2CCCC2)=CC=C1OC1CC1.
What is the InChIKey of 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine?
The InChIKey is TZKPLTVXCRKUOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-17-13-14(5-4-12-18-10-2-3-11-18)6-9-16(17)19-15-7-8-15/h6,9,15H,2-5,7-8,10-13H2,1H3.
What are the key properties of 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine?
6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine has a molecular weight of 262.40 g/mol, XLogP of 2.75, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine is sourced from PubChem (CID 134288593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).