6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine

C15H24N2O — CID 134288453

IUPAC6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine
SMILESC1=C(CCCN2CCCC2)CNC(OC2CC2)=C1
InChIInChI=1S/C15H24N2O/c1-2-10-17(9-1)11-3-4-13-5-8-15(16-12-13)18-14-6-7-14/h5,8,14,16H,1-4,6-7,9-12H2
InChIKeyQTNBYJMUNBBZGR-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.41
Rot. Bonds6

About 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine

6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine (PubChem CID 134288453) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine.

Molecular Properties

Compound Name6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine
PubChem CID134288453
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine
SMILESC1=C(CCCN2CCCC2)CNC(OC2CC2)=C1
InChIInChI=1S/C15H24N2O/c1-2-10-17(9-1)11-3-4-13-5-8-15(16-12-13)18-14-6-7-14/h5,8,14,16H,1-4,6-7,9-12H2
InChIKeyQTNBYJMUNBBZGR-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine 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

(1E,3E)-4-methyl-1-propan-2-yloxy-7-pyrrolidin-1-ylhepta-1,3-dien-1-amine
CID 134288485
6-cyclopropyloxy-1-methyl-3-(3-pyrrolidin-1-ylpropyl)-2H-pyridine
CID 134288593

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine?
The IUPAC name of 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine (CID 134288453) is 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine.
What is the SMILES notation for 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine?
The canonical SMILES for 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine is C1=C(CCCN2CCCC2)CNC(OC2CC2)=C1.
What is the InChIKey of 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine?
The InChIKey is QTNBYJMUNBBZGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-10-17(9-1)11-3-4-13-5-8-15(16-12-13)18-14-6-7-14/h5,8,14,16H,1-4,6-7,9-12H2.
What are the key properties of 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine?
6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine has a molecular weight of 248.37 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyloxy-3-(3-pyrrolidin-1-ylpropyl)-1,2-dihydropyridine is sourced from PubChem (CID 134288453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).