N-hexyl-N,1-dimethylpiperidin-3-amine

C13H28N2 — CID 71906386

IUPACN-hexyl-N,1-dimethylpiperidin-3-amine
SMILESCCCCCCN(C)C1CCCN(C)C1
InChIInChI=1S/C13H28N2/c1-4-5-6-7-11-15(3)13-9-8-10-14(2)12-13/h13H,4-12H2,1-3H3
InChIKeyJZYYMSVTHGAEMI-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.59
Rot. Bonds6

About N-hexyl-N,1-dimethylpiperidin-3-amine

N-hexyl-N,1-dimethylpiperidin-3-amine (PubChem CID 71906386) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-hexyl-N,1-dimethylpiperidin-3-amine.

Molecular Properties

Compound NameN-hexyl-N,1-dimethylpiperidin-3-amine
PubChem CID71906386
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-hexyl-N,1-dimethylpiperidin-3-amine
SMILESCCCCCCN(C)C1CCCN(C)C1
InChIInChI=1S/C13H28N2/c1-4-5-6-7-11-15(3)13-9-8-10-14(2)12-13/h13H,4-12H2,1-3H3
InChIKeyJZYYMSVTHGAEMI-UHFFFAOYSA-N
XLogP2.59
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

9-[methyl-(1-methylpiperidin-3-yl)amino]nonane-1-thiol
CID 105343956
N'-methyl-N'-(1-methylpiperidin-3-yl)propane-1,3-diamine
CID 62545866
N-methyl-N-pentylcyclobutanamine
CID 142562644
2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol
CID 66565626
N'-hydroxy-5-[methyl-(1-methylpiperidin-3-yl)amino]pentanimidamide
CID 55084848
N,N,N'-trimethyl-N'-[(3S)-1-methylpyrrolidin-3-yl]propane-1,3-diamine
CID 118516090
N'-methyl-N'-(1-methylpiperidin-3-yl)-N-(2-methylpropyl)propane-1,3-diamine
CID 62547703
1-N-methyl-1-N-(1-methylpiperidin-3-yl)-3-N-propylbutane-1,3-diamine
CID 62546063
N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine
CID 79327766
2-ethyl-2-(ethylamino)-5-[methyl-(1-methylpiperidin-3-yl)amino]pentan-1-ol
CID 106808673
4-[methyl-(1-methylpiperidin-3-yl)amino]-2-(propylamino)butan-1-ol
CID 64787609
N,1-dimethyl-N-octylpiperidine-3-carboxamide
CID 14306886

Frequently Asked Questions

What is the IUPAC name of N-hexyl-N,1-dimethylpiperidin-3-amine?
The IUPAC name of N-hexyl-N,1-dimethylpiperidin-3-amine (CID 71906386) is N-hexyl-N,1-dimethylpiperidin-3-amine.
What is the SMILES notation for N-hexyl-N,1-dimethylpiperidin-3-amine?
The canonical SMILES for N-hexyl-N,1-dimethylpiperidin-3-amine is CCCCCCN(C)C1CCCN(C)C1.
What is the InChIKey of N-hexyl-N,1-dimethylpiperidin-3-amine?
The InChIKey is JZYYMSVTHGAEMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-4-5-6-7-11-15(3)13-9-8-10-14(2)12-13/h13H,4-12H2,1-3H3.
What are the key properties of N-hexyl-N,1-dimethylpiperidin-3-amine?
N-hexyl-N,1-dimethylpiperidin-3-amine has a molecular weight of 212.38 g/mol, XLogP of 2.59, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-N,1-dimethylpiperidin-3-amine is sourced from PubChem (CID 71906386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).