5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine

C12H27N3 — CID 114537725

IUPAC5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
SMILESCC(N)CCCN1CC(C)N(C)C(C)C1
InChIInChI=1S/C12H27N3/c1-10(13)6-5-7-15-8-11(2)14(4)12(3)9-15/h10-12H,5-9,13H2,1-4H3
InChIKeyAFLZFYBRGCRKQK-UHFFFAOYSA-N
MW213.37 g/mol
LogP1.14
Rot. Bonds4

About 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine

5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine (PubChem CID 114537725) has the molecular formula C12H27N3 and a molecular weight of 213.37 g/mol. Its IUPAC name is 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine.

Molecular Properties

Compound Name5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
PubChem CID114537725
Molecular FormulaC12H27N3
Molecular Weight213.37 g/mol
Exact Mass213.22
IUPAC Name5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
SMILESCC(N)CCCN1CC(C)N(C)C(C)C1
InChIInChI=1S/C12H27N3/c1-10(13)6-5-7-15-8-11(2)14(4)12(3)9-15/h10-12H,5-9,13H2,1-4H3
InChIKeyAFLZFYBRGCRKQK-UHFFFAOYSA-N
XLogP1.14
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.37
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-butyl-1,2,6-trimethylpiperazine
CID 126991132
2-methyl-5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
CID 114547158
N-propyl-5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
CID 114537915
(2S,6S)-1,2,6-trimethyl-4-(2-methylpropyl)piperazine
CID 171515774
5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)pentan-2-amine
CID 79175495
N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine
CID 106800125
2-amino-4-(3,4,5-trimethylpiperazin-1-yl)butanenitrile
CID 114539222
1-ethyl-2,6-dimethyl-4-(4-methylpentyl)piperazine
CID 123267329
5-(4,4-dimethylpiperidin-1-yl)pentan-2-amine
CID 62935849
(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine
CID 138484607
5-(3-methoxypyrrolidin-1-yl)pentan-2-amine
CID 103532229
N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide
CID 104937397

Frequently Asked Questions

What is the IUPAC name of 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine?
The IUPAC name of 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine (CID 114537725) is 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine.
What is the SMILES notation for 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine?
The canonical SMILES for 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine is CC(N)CCCN1CC(C)N(C)C(C)C1.
What is the InChIKey of 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine?
The InChIKey is AFLZFYBRGCRKQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3/c1-10(13)6-5-7-15-8-11(2)14(4)12(3)9-15/h10-12H,5-9,13H2,1-4H3.
What are the key properties of 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine?
5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine has a molecular weight of 213.37 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine is sourced from PubChem (CID 114537725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).