N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine

C15H33N3 — CID 106800125

IUPACN-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine
SMILESCCNC(CC)CCCN1CC(C)N(C)C(C)C1
InChIInChI=1S/C15H33N3/c1-6-15(16-7-2)9-8-10-18-11-13(3)17(5)14(4)12-18/h13-16H,6-12H2,1-5H3
InChIKeyZDKUODINWSEJIB-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.18
Rot. Bonds7

About N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine

N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine (PubChem CID 106800125) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine.

Molecular Properties

Compound NameN-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine
PubChem CID106800125
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC NameN-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine
SMILESCCNC(CC)CCCN1CC(C)N(C)C(C)C1
InChIInChI=1S/C15H33N3/c1-6-15(16-7-2)9-8-10-18-11-13(3)17(5)14(4)12-18/h13-16H,6-12H2,1-5H3
InChIKeyZDKUODINWSEJIB-UHFFFAOYSA-N
XLogP2.18
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-cyclopropylpiperazin-1-yl)-N-ethylhexan-3-amine
CID 106799531
6-(4-tert-butylpiperidin-1-yl)-N-ethylhexan-3-amine
CID 106799710
4-butyl-1,2,6-trimethylpiperazine
CID 126991132
N-propyl-5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
CID 114537915
6-[4-[(dimethylamino)methyl]piperidin-1-yl]-N-ethylhexan-3-amine
CID 106799572
6-(4-ethyl-3-methylpiperazin-1-yl)-N-propylhexan-3-amine
CID 106799849
N-ethyl-1-(3,4,5-trimethylpiperazin-1-yl)propan-2-amine
CID 114537771
N-ethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)hexan-3-amine
CID 106800011
5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
CID 114537725
2-(ethylamino)-3-(3,4,5-trimethylpiperazin-1-yl)propanenitrile
CID 114539184
(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine
CID 138484607
1-[4-(ethylamino)hexyl]-4-propan-2-ylpyrrolidin-2-one
CID 106800567

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine?
The IUPAC name of N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine (CID 106800125) is N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine.
What is the SMILES notation for N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine?
The canonical SMILES for N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine is CCNC(CC)CCCN1CC(C)N(C)C(C)C1.
What is the InChIKey of N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine?
The InChIKey is ZDKUODINWSEJIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-6-15(16-7-2)9-8-10-18-11-13(3)17(5)14(4)12-18/h13-16H,6-12H2,1-5H3.
What are the key properties of N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine?
N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine has a molecular weight of 255.45 g/mol, XLogP of 2.18, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine is sourced from PubChem (CID 106800125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).