6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine

C13H25N3 — CID 165476058

IUPAC6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine
SMILESCN1CCN(C2CCC3(CC2)CC3N)CC1
InChIInChI=1S/C13H25N3/c1-15-6-8-16(9-7-15)11-2-4-13(5-3-11)10-12(13)14/h11-12H,2-10,14H2,1H3
InChIKeyNHCOGIMZQSYYLU-UHFFFAOYSA-N
MW223.36 g/mol
LogP0.89
Rot. Bonds1

About 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine

6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine (PubChem CID 165476058) has the molecular formula C13H25N3 and a molecular weight of 223.36 g/mol. Its IUPAC name is 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine.

Molecular Properties

Compound Name6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine
PubChem CID165476058
Molecular FormulaC13H25N3
Molecular Weight223.36 g/mol
Exact Mass223.20
IUPAC Name6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine
SMILESCN1CCN(C2CCC3(CC2)CC3N)CC1
InChIInChI=1S/C13H25N3/c1-15-6-8-16(9-7-15)11-2-4-13(5-3-11)10-12(13)14/h11-12H,2-10,14H2,1H3
InChIKeyNHCOGIMZQSYYLU-UHFFFAOYSA-N
XLogP0.89
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-piperidin-1-ylspiro[2.5]octan-2-amine
CID 165487201
ethane;1-methyl-4-(1-methylpiperidin-4-yl)piperazine
CID 144911273
1-amino-3-(4-methylpiperazin-1-yl)cyclopentane-1-carboxamide
CID 79650015
1-(2-aminospiro[2.5]octan-6-yl)piperidine-3-carboxylic acid
CID 165487197
1-(methylaminomethyl)-4-(4-methylpiperazin-1-yl)cyclohexan-1-ol
CID 117038143
1-(4-iodocyclohexyl)-4-methylpiperazine
CID 134444835
1-methyl-4-piperidin-4-ylpiperazine;hydrochloride
CID 45074780
8-cyclopropyl-1-methyl-1,8-diazaspiro[4.5]decan-4-amine
CID 165464224
1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine
CID 142483010
[4-(4-methylpiperazin-1-yl)piperidin-1-yl]methanethiol
CID 163434092
7-(4-methyl-1,4-diazepan-1-yl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 43211400
1-cyclopropyl-4-methylpiperazine;1,2,4-trimethylpiperazine
CID 142374718

Frequently Asked Questions

What is the IUPAC name of 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine?
The IUPAC name of 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine (CID 165476058) is 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine.
What is the SMILES notation for 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine?
The canonical SMILES for 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine is CN1CCN(C2CCC3(CC2)CC3N)CC1.
What is the InChIKey of 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine?
The InChIKey is NHCOGIMZQSYYLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3/c1-15-6-8-16(9-7-15)11-2-4-13(5-3-11)10-12(13)14/h11-12H,2-10,14H2,1H3.
What are the key properties of 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine?
6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine has a molecular weight of 223.36 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylpiperazin-1-yl)spiro[2.5]octan-2-amine is sourced from PubChem (CID 165476058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).