N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine

C13H20N2O2 — CID 63556915

IUPACN-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)NCc1ccc(OC2CCOC2)nc1
InChIInChI=1S/C13H20N2O2/c1-10(2)14-7-11-3-4-13(15-8-11)17-12-5-6-16-9-12/h3-4,8,10,12,14H,5-7,9H2,1-2H3
InChIKeyCWJGEPNPDQERHE-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.75
Rot. Bonds5

About N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine

N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine (PubChem CID 63556915) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine
PubChem CID63556915
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)NCc1ccc(OC2CCOC2)nc1
InChIInChI=1S/C13H20N2O2/c1-10(2)14-7-11-3-4-13(15-8-11)17-12-5-6-16-9-12/h3-4,8,10,12,14H,5-7,9H2,1-2H3
InChIKeyCWJGEPNPDQERHE-UHFFFAOYSA-N
XLogP1.75
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[6-(4,4-dimethylcyclohexyl)oxy-3-pyridinyl]methyl]propan-2-amine
CID 114342292
[6-(oxolan-3-yloxy)-3-pyridinyl]methanamine
CID 63559217
5-(chloromethyl)-2-(oxolan-3-yloxy)pyridine
CID 63557481
N-[[3-chloro-4-(oxolan-3-yloxy)phenyl]methyl]propan-2-amine
CID 63556375
N-[[6-(oxolan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62291428
2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol
CID 71182932
N-[[6-(2-methylpropoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62289960
N-[[4-nitro-3-(oxolan-3-yloxy)phenyl]methyl]propan-2-amine
CID 63557345
N-[(6-cyclohexyloxy-3-pyridinyl)methyl]-1-pyrazin-2-ylethanamine
CID 75427846
2-methyl-N-[[2-(oxolan-3-yloxy)-4-pyridinyl]methyl]propan-1-amine
CID 55212360
N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine
CID 62298054
2-methyl-N-[[5-(oxolan-3-yloxy)pyrazin-2-yl]methyl]propan-2-amine
CID 107382130

Frequently Asked Questions

What is the IUPAC name of N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine (CID 63556915) is N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine is CC(C)NCc1ccc(OC2CCOC2)nc1.
What is the InChIKey of N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine?
The InChIKey is CWJGEPNPDQERHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(2)14-7-11-3-4-13(15-8-11)17-12-5-6-16-9-12/h3-4,8,10,12,14H,5-7,9H2,1-2H3.
What are the key properties of N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine?
N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine has a molecular weight of 236.31 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(oxolan-3-yloxy)-3-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 63556915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).