3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine

C12H24N2O — CID 135165135

IUPAC3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine
SMILESC=C(CC1CCN(CCOC)CC1)NC
InChIInChI=1S/C12H24N2O/c1-11(13-2)10-12-4-6-14(7-5-12)8-9-15-3/h12-13H,1,4-10H2,2-3H3
InChIKeyANBMMVQIYMSANA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.47
Rot. Bonds6

About 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine

3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine (PubChem CID 135165135) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine.

Molecular Properties

Compound Name3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine
PubChem CID135165135
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine
SMILESC=C(CC1CCN(CCOC)CC1)NC
InChIInChI=1S/C12H24N2O/c1-11(13-2)10-12-4-6-14(7-5-12)8-9-15-3/h12-13H,1,4-10H2,2-3H3
InChIKeyANBMMVQIYMSANA-UHFFFAOYSA-N
XLogP1.47
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine?
The IUPAC name of 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine (CID 135165135) is 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine.
What is the SMILES notation for 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine?
The canonical SMILES for 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine is C=C(CC1CCN(CCOC)CC1)NC.
What is the InChIKey of 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine?
The InChIKey is ANBMMVQIYMSANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-11(13-2)10-12-4-6-14(7-5-12)8-9-15-3/h12-13H,1,4-10H2,2-3H3.
What are the key properties of 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine?
3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine has a molecular weight of 212.34 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine is sourced from PubChem (CID 135165135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).