2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine

C16H32N2O — CID 63971324

IUPAC2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine
SMILESCNC1CCCCCCC1N1CCC(COC)CC1
InChIInChI=1S/C16H32N2O/c1-17-15-7-5-3-4-6-8-16(15)18-11-9-14(10-12-18)13-19-2/h14-17H,3-13H2,1-2H3
InChIKeyBQCDQWVXUABGGO-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.66
Rot. Bonds4

About 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine

2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine (PubChem CID 63971324) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine.

Molecular Properties

Compound Name2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine
PubChem CID63971324
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine
SMILESCNC1CCCCCCC1N1CCC(COC)CC1
InChIInChI=1S/C16H32N2O/c1-17-15-7-5-3-4-6-8-16(15)18-11-9-14(10-12-18)13-19-2/h14-17H,3-13H2,1-2H3
InChIKeyBQCDQWVXUABGGO-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine?
The IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine (CID 63971324) is 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine.
What is the SMILES notation for 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine?
The canonical SMILES for 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine is CNC1CCCCCCC1N1CCC(COC)CC1.
What is the InChIKey of 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine?
The InChIKey is BQCDQWVXUABGGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-17-15-7-5-3-4-6-8-16(15)18-11-9-14(10-12-18)13-19-2/h14-17H,3-13H2,1-2H3.
What are the key properties of 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine?
2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine has a molecular weight of 268.44 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine is sourced from PubChem (CID 63971324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).