3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine

C14H26N2O — CID 102963855

IUPAC3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine
SMILESCOC1CCCN(CC2C3CCC(C3)C2N)C1
InChIInChI=1S/C14H26N2O/c1-17-12-3-2-6-16(8-12)9-13-10-4-5-11(7-10)14(13)15/h10-14H,2-9,15H2,1H3
InChIKeyUXFFREJXKBUACA-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.47
Rot. Bonds3

About 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine

3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine (PubChem CID 102963855) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound Name3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine
PubChem CID102963855
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine
SMILESCOC1CCCN(CC2C3CCC(C3)C2N)C1
InChIInChI=1S/C14H26N2O/c1-17-12-3-2-6-16(8-12)9-13-10-4-5-11(7-10)14(13)15/h10-14H,2-9,15H2,1H3
InChIKeyUXFFREJXKBUACA-UHFFFAOYSA-N
XLogP1.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 102967402
1-[2-(3-methoxypiperidin-1-yl)ethyl]piperidin-4-amine
CID 102963901
3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine
CID 103534683
2-[(3-methoxypiperidin-1-yl)methyl]cyclohexan-1-one
CID 102966895
2-methoxy-3-(3-methoxypiperidin-1-yl)propan-1-amine
CID 106115075
(3R)-1-(cyclopentylmethyl)-3-methoxypyrrolidine
CID 126986050
1-(3-methoxypiperidin-1-yl)-2-methylbutan-2-amine
CID 102963723
2-amino-3-(3-methoxypiperidin-1-yl)propan-1-ol
CID 102968945
2-[(3-ethoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64735456
[4-[2-(3-methoxypiperidin-1-yl)ethoxy]phenyl]methanamine
CID 102956615
5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine
CID 102963876
3-(3-methoxypiperidin-1-yl)-2-methylpropanethioamide
CID 102958133

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine?
The IUPAC name of 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine (CID 102963855) is 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine is COC1CCCN(CC2C3CCC(C3)C2N)C1.
What is the InChIKey of 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine?
The InChIKey is UXFFREJXKBUACA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-17-12-3-2-6-16(8-12)9-13-10-4-5-11(7-10)14(13)15/h10-14H,2-9,15H2,1H3.
What are the key properties of 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine?
3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine has a molecular weight of 238.37 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 102963855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).