1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine

C13H26N2O — CID 71054955

IUPAC1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine
SMILESCOCC1CCC(N2CCC(N)CC2)CC1
InChIInChI=1S/C13H26N2O/c1-16-10-11-2-4-13(5-3-11)15-8-6-12(14)7-9-15/h11-13H,2-10,14H2,1H3
InChIKeyHUIPIICPYPMYCG-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.61
Rot. Bonds3

About 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine

1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine (PubChem CID 71054955) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine
PubChem CID71054955
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine
SMILESCOCC1CCC(N2CCC(N)CC2)CC1
InChIInChI=1S/C13H26N2O/c1-16-10-11-2-4-13(5-3-11)15-8-6-12(14)7-9-15/h11-13H,2-10,14H2,1H3
InChIKeyHUIPIICPYPMYCG-UHFFFAOYSA-N
XLogP1.61
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine?
The IUPAC name of 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine (CID 71054955) is 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine.
What is the SMILES notation for 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine?
The canonical SMILES for 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine is COCC1CCC(N2CCC(N)CC2)CC1.
What is the InChIKey of 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine?
The InChIKey is HUIPIICPYPMYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-16-10-11-2-4-13(5-3-11)15-8-6-12(14)7-9-15/h11-13H,2-10,14H2,1H3.
What are the key properties of 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine?
1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine has a molecular weight of 226.36 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine is sourced from PubChem (CID 71054955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).