2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine

C15H30N2O — CID 83007696

IUPAC2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine
SMILESCCCC1CC(NN2C(C)CCCC2C)CCO1
InChIInChI=1S/C15H30N2O/c1-4-6-15-11-14(9-10-18-15)16-17-12(2)7-5-8-13(17)3/h12-16H,4-11H2,1-3H3
InChIKeyITUKLUXNVWZAAG-UHFFFAOYSA-N
MW254.42 g/mol
LogP3.10
Rot. Bonds4

About 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine

2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine (PubChem CID 83007696) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine
PubChem CID83007696
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine
SMILESCCCC1CC(NN2C(C)CCCC2C)CCO1
InChIInChI=1S/C15H30N2O/c1-4-6-15-11-14(9-10-18-15)16-17-12(2)7-5-8-13(17)3/h12-16H,4-11H2,1-3H3
InChIKeyITUKLUXNVWZAAG-UHFFFAOYSA-N
XLogP3.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine?
The IUPAC name of 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine (CID 83007696) is 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine.
What is the SMILES notation for 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine?
The canonical SMILES for 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine is CCCC1CC(NN2C(C)CCCC2C)CCO1.
What is the InChIKey of 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine?
The InChIKey is ITUKLUXNVWZAAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-6-15-11-14(9-10-18-15)16-17-12(2)7-5-8-13(17)3/h12-16H,4-11H2,1-3H3.
What are the key properties of 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine?
2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine has a molecular weight of 254.42 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine is sourced from PubChem (CID 83007696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).