N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine

C14H28N2O — CID 114503263

IUPACN-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine
SMILESCCC1CC(NC2CCN(C)CC2C)CCO1
InChIInChI=1S/C14H28N2O/c1-4-13-9-12(6-8-17-13)15-14-5-7-16(3)10-11(14)2/h11-15H,4-10H2,1-3H3
InChIKeyHFVOKPSGHCUQAR-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.87
Rot. Bonds3

About N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine

N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine (PubChem CID 114503263) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine
PubChem CID114503263
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine
SMILESCCC1CC(NC2CCN(C)CC2C)CCO1
InChIInChI=1S/C14H28N2O/c1-4-13-9-12(6-8-17-13)15-14-5-7-16(3)10-11(14)2/h11-15H,4-10H2,1-3H3
InChIKeyHFVOKPSGHCUQAR-UHFFFAOYSA-N
XLogP1.87
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine?
The IUPAC name of N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine (CID 114503263) is N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine.
What is the SMILES notation for N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine?
The canonical SMILES for N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine is CCC1CC(NC2CCN(C)CC2C)CCO1.
What is the InChIKey of N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine?
The InChIKey is HFVOKPSGHCUQAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-13-9-12(6-8-17-13)15-14-5-7-16(3)10-11(14)2/h11-15H,4-10H2,1-3H3.
What are the key properties of N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine?
N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine has a molecular weight of 240.39 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyloxan-4-yl)-1,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 114503263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).