1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine

C10H22N2O — CID 20646568

IUPAC1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine
SMILESCNC(COC)CC1CCNCC1
InChIInChI=1S/C10H22N2O/c1-11-10(8-13-2)7-9-3-5-12-6-4-9/h9-12H,3-8H2,1-2H3
InChIKeyFPAQWDXOCZUKSQ-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.61
Rot. Bonds5

About 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine

1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine (PubChem CID 20646568) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine.

Molecular Properties

Compound Name1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine
PubChem CID20646568
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine
SMILESCNC(COC)CC1CCNCC1
InChIInChI=1S/C10H22N2O/c1-11-10(8-13-2)7-9-3-5-12-6-4-9/h9-12H,3-8H2,1-2H3
InChIKeyFPAQWDXOCZUKSQ-UHFFFAOYSA-N
XLogP0.61
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine?
The IUPAC name of 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine (CID 20646568) is 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine.
What is the SMILES notation for 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine?
The canonical SMILES for 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine is CNC(COC)CC1CCNCC1.
What is the InChIKey of 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine?
The InChIKey is FPAQWDXOCZUKSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-11-10(8-13-2)7-9-3-5-12-6-4-9/h9-12H,3-8H2,1-2H3.
What are the key properties of 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine?
1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine has a molecular weight of 186.30 g/mol, XLogP of 0.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine is sourced from PubChem (CID 20646568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).