N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine

C13H22N2O2 — CID 103228028

IUPACN-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine
SMILESCOCC(CNC(C)(C)C)Oc1cccnc1
InChIInChI=1S/C13H22N2O2/c1-13(2,3)15-9-12(10-16-4)17-11-6-5-7-14-8-11/h5-8,12,15H,9-10H2,1-4H3
InChIKeyQFGOXHRDFYGBQV-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.86
Rot. Bonds6

About N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine

N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine (PubChem CID 103228028) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine
PubChem CID103228028
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC NameN-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine
SMILESCOCC(CNC(C)(C)C)Oc1cccnc1
InChIInChI=1S/C13H22N2O2/c1-13(2,3)15-9-12(10-16-4)17-11-6-5-7-14-8-11/h5-8,12,15H,9-10H2,1-4H3
InChIKeyQFGOXHRDFYGBQV-UHFFFAOYSA-N
XLogP1.86
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine?
The IUPAC name of N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine (CID 103228028) is N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine.
What is the SMILES notation for N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine?
The canonical SMILES for N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine is COCC(CNC(C)(C)C)Oc1cccnc1.
What is the InChIKey of N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine?
The InChIKey is QFGOXHRDFYGBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-13(2,3)15-9-12(10-16-4)17-11-6-5-7-14-8-11/h5-8,12,15H,9-10H2,1-4H3.
What are the key properties of N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine?
N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine has a molecular weight of 238.33 g/mol, XLogP of 1.86, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-2-pyridin-3-yloxypropyl)-2-methylpropan-2-amine is sourced from PubChem (CID 103228028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).