N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine

C15H30N2 — CID 115710210

IUPACN-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine
SMILESCCC1CCC(NC2CCN(C)CC2C)CC1
InChIInChI=1S/C15H30N2/c1-4-13-5-7-14(8-6-13)16-15-9-10-17(3)11-12(15)2/h12-16H,4-11H2,1-3H3
InChIKeyTXUMCQMMQLUFKQ-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds3

About N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine

N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine (PubChem CID 115710210) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine
PubChem CID115710210
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine
SMILESCCC1CCC(NC2CCN(C)CC2C)CC1
InChIInChI=1S/C15H30N2/c1-4-13-5-7-14(8-6-13)16-15-9-10-17(3)11-12(15)2/h12-16H,4-11H2,1-3H3
InChIKeyTXUMCQMMQLUFKQ-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine?
The IUPAC name of N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine (CID 115710210) is N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine.
What is the SMILES notation for N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine?
The canonical SMILES for N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine is CCC1CCC(NC2CCN(C)CC2C)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine?
The InChIKey is TXUMCQMMQLUFKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-13-5-7-14(8-6-13)16-15-9-10-17(3)11-12(15)2/h12-16H,4-11H2,1-3H3.
What are the key properties of N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine?
N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-1,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 115710210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).