N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine

C15H32N2 — CID 113287541

IUPACN,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine
SMILESCNC1CCN(CCCCC(C)C)C(C)C1C
InChIInChI=1S/C15H32N2/c1-12(2)8-6-7-10-17-11-9-15(16-5)13(3)14(17)4/h12-16H,6-11H2,1-5H3
InChIKeyHEKNHBUQPWAABQ-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.13
Rot. Bonds6

About N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine

N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine (PubChem CID 113287541) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine.

Molecular Properties

Compound NameN,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine
PubChem CID113287541
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine
SMILESCNC1CCN(CCCCC(C)C)C(C)C1C
InChIInChI=1S/C15H32N2/c1-12(2)8-6-7-10-17-11-9-15(16-5)13(3)14(17)4/h12-16H,6-11H2,1-5H3
InChIKeyHEKNHBUQPWAABQ-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-(2-methoxyethoxy)ethyl]-N,2,3-trimethylpiperidin-4-amine
CID 79407787
N,2,3-trimethyl-1-(2-thiomorpholin-4-ylethyl)piperidin-4-amine
CID 114173850
2-methyl-1-(5-methylhexyl)piperidine
CID 142939607
2,3-dimethyl-1-(5-methylhexyl)piperidin-4-one
CID 115325870
N,2,3-trimethyl-1-(2-thiophen-3-ylethyl)piperidin-4-amine
CID 79398307
1-[2-(furan-2-yl)ethyl]-N,2,3-trimethylpiperidin-4-amine
CID 79398564
N,2,3-trimethyl-1-[2-(1,2,4-oxadiazol-5-yl)ethyl]piperidin-4-amine
CID 106402216
1-[4-(dimethylamino)butyl]-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79406875
1-[(4-methoxyphenyl)methyl]-N,2,3-trimethylpiperidin-4-amine
CID 79397697
1-[3-(dimethylamino)propyl]-N-ethyl-2,3-dimethylpiperidin-4-amine
CID 79397146
1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397144
N-ethyl-2,3-dimethyl-1-(3-methylsulfonylpropyl)piperidin-4-amine
CID 79407263

Frequently Asked Questions

What is the IUPAC name of N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine?
The IUPAC name of N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine (CID 113287541) is N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine.
What is the SMILES notation for N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine?
The canonical SMILES for N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine is CNC1CCN(CCCCC(C)C)C(C)C1C.
What is the InChIKey of N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine?
The InChIKey is HEKNHBUQPWAABQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-12(2)8-6-7-10-17-11-9-15(16-5)13(3)14(17)4/h12-16H,6-11H2,1-5H3.
What are the key properties of N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine?
N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine has a molecular weight of 240.43 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,3-trimethyl-1-(5-methylhexyl)piperidin-4-amine is sourced from PubChem (CID 113287541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).