3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine

C12H23NO2 — CID 170139887

IUPAC3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine
SMILESCOC1COCCC1NC1CCC(C)C1
InChIInChI=1S/C12H23NO2/c1-9-3-4-10(7-9)13-11-5-6-15-8-12(11)14-2/h9-13H,3-8H2,1-2H3
InChIKeyFZPVYACELFIITN-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.57
Rot. Bonds3

About 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine

3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine (PubChem CID 170139887) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine.

Molecular Properties

Compound Name3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine
PubChem CID170139887
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine
SMILESCOC1COCCC1NC1CCC(C)C1
InChIInChI=1S/C12H23NO2/c1-9-3-4-10(7-9)13-11-5-6-15-8-12(11)14-2/h9-13H,3-8H2,1-2H3
InChIKeyFZPVYACELFIITN-UHFFFAOYSA-N
XLogP1.57
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine?
The IUPAC name of 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine (CID 170139887) is 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine.
What is the SMILES notation for 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine?
The canonical SMILES for 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine is COC1COCCC1NC1CCC(C)C1.
What is the InChIKey of 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine?
The InChIKey is FZPVYACELFIITN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-9-3-4-10(7-9)13-11-5-6-15-8-12(11)14-2/h9-13H,3-8H2,1-2H3.
What are the key properties of 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine?
3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine has a molecular weight of 213.32 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(3-methylcyclopentyl)oxan-4-amine is sourced from PubChem (CID 170139887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).