1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine

C12H24N2O — CID 63971523

IUPAC1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine
SMILESCOCC1CCN(CC(N)C2CC2)CC1
InChIInChI=1S/C12H24N2O/c1-15-9-10-4-6-14(7-5-10)8-12(13)11-2-3-11/h10-12H,2-9,13H2,1H3
InChIKeyZXKPBXCMVROQPX-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.08
Rot. Bonds5

About 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine

1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine (PubChem CID 63971523) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine
PubChem CID63971523
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine
SMILESCOCC1CCN(CC(N)C2CC2)CC1
InChIInChI=1S/C12H24N2O/c1-15-9-10-4-6-14(7-5-10)8-12(13)11-2-3-11/h10-12H,2-9,13H2,1H3
InChIKeyZXKPBXCMVROQPX-UHFFFAOYSA-N
XLogP1.08
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine?
The IUPAC name of 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine (CID 63971523) is 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine?
The canonical SMILES for 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine is COCC1CCN(CC(N)C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine?
The InChIKey is ZXKPBXCMVROQPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-15-9-10-4-6-14(7-5-10)8-12(13)11-2-3-11/h10-12H,2-9,13H2,1H3.
What are the key properties of 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine?
1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine has a molecular weight of 212.34 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine is sourced from PubChem (CID 63971523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).