N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine

C14H28N2 — CID 83006874

IUPACN-(3,3,5-trimethylcyclohexyl)piperidin-1-amine
SMILESCC1CC(NN2CCCCC2)CC(C)(C)C1
InChIInChI=1S/C14H28N2/c1-12-9-13(11-14(2,3)10-12)15-16-7-5-4-6-8-16/h12-13,15H,4-11H2,1-3H3
InChIKeyCINKSPMLXSPQNH-UHFFFAOYSA-N
MW224.39 g/mol
LogP3.19
Rot. Bonds2

About N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine

N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine (PubChem CID 83006874) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine.

Molecular Properties

Compound NameN-(3,3,5-trimethylcyclohexyl)piperidin-1-amine
PubChem CID83006874
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-(3,3,5-trimethylcyclohexyl)piperidin-1-amine
SMILESCC1CC(NN2CCCCC2)CC(C)(C)C1
InChIInChI=1S/C14H28N2/c1-12-9-13(11-14(2,3)10-12)15-16-7-5-4-6-8-16/h12-13,15H,4-11H2,1-3H3
InChIKeyCINKSPMLXSPQNH-UHFFFAOYSA-N
XLogP3.19
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine?
The IUPAC name of N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine (CID 83006874) is N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine.
What is the SMILES notation for N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine?
The canonical SMILES for N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine is CC1CC(NN2CCCCC2)CC(C)(C)C1.
What is the InChIKey of N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine?
The InChIKey is CINKSPMLXSPQNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-12-9-13(11-14(2,3)10-12)15-16-7-5-4-6-8-16/h12-13,15H,4-11H2,1-3H3.
What are the key properties of N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine?
N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine has a molecular weight of 224.39 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3,5-trimethylcyclohexyl)piperidin-1-amine is sourced from PubChem (CID 83006874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).