[2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine

C16H33N3 — CID 114537518

IUPAC[2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine
SMILESCC1CCC(C)C(CN)(N2CC(C)N(C)C(C)C2)C1
InChIInChI=1S/C16H33N3/c1-12-6-7-13(2)16(8-12,11-17)19-9-14(3)18(5)15(4)10-19/h12-15H,6-11,17H2,1-5H3
InChIKeyZUEYFMJODBYIDB-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.16
Rot. Bonds2

About [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine

[2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine (PubChem CID 114537518) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine
PubChem CID114537518
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC Name[2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine
SMILESCC1CCC(C)C(CN)(N2CC(C)N(C)C(C)C2)C1
InChIInChI=1S/C16H33N3/c1-12-6-7-13(2)16(8-12,11-17)19-9-14(3)18(5)15(4)10-19/h12-15H,6-11,17H2,1-5H3
InChIKeyZUEYFMJODBYIDB-UHFFFAOYSA-N
XLogP2.16
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(4-ethylpiperidin-1-yl)-2,5-dimethylcyclohexyl]methanamine
CID 64762341
[2,5-dimethyl-1-(2-methylmorpholin-4-yl)cyclohexyl]methanamine
CID 64760139
[2,5-dimethyl-1-(4-methylsulfanylpiperidin-1-yl)cyclohexyl]methanamine
CID 114236814
[2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 64760563
[2,5-dimethyl-1-(3-piperidin-1-ylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 64763152
[2,5-dimethyl-1-(2-methyl-1,4-oxazepan-4-yl)cyclohexyl]methanamine
CID 64761755
[1-(4-ethyl-4-methylpiperidin-1-yl)-2,5-dimethylcyclohexyl]methanamine
CID 64763143
[2,5-dimethyl-1-(1,4-thiazepan-4-yl)cyclohexyl]methanamine
CID 64761949
[2,5-dimethyl-1-(3-methylmorpholin-4-yl)cyclohexyl]methanamine
CID 64760752
[3-ethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclopentyl]methanamine
CID 114537628
[1-methyl-4-(3,4,5-trimethylpiperazin-1-yl)azepan-4-yl]methanamine
CID 114537563
[8-(3,4,5-trimethylpiperazin-1-yl)spiro[4.5]decan-8-yl]methanamine
CID 114818266

Frequently Asked Questions

What is the IUPAC name of [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine?
The IUPAC name of [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine (CID 114537518) is [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine.
What is the SMILES notation for [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine?
The canonical SMILES for [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine is CC1CCC(C)C(CN)(N2CC(C)N(C)C(C)C2)C1.
What is the InChIKey of [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine?
The InChIKey is ZUEYFMJODBYIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-12-6-7-13(2)16(8-12,11-17)19-9-14(3)18(5)15(4)10-19/h12-15H,6-11,17H2,1-5H3.
What are the key properties of [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine?
[2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine has a molecular weight of 267.46 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2,5-dimethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclohexyl]methanamine is sourced from PubChem (CID 114537518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).