1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine

C16H32N2 — CID 64937246

IUPAC1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine
SMILESCC1CCC(N2CC(C)NCC2C(C)C)C(C)C1
InChIInChI=1S/C16H32N2/c1-11(2)16-9-17-14(5)10-18(16)15-7-6-12(3)8-13(15)4/h11-17H,6-10H2,1-5H3
InChIKeyDRQQXXNTKIALJL-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.13
Rot. Bonds2

About 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine

1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine (PubChem CID 64937246) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine
PubChem CID64937246
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine
SMILESCC1CCC(N2CC(C)NCC2C(C)C)C(C)C1
InChIInChI=1S/C16H32N2/c1-11(2)16-9-17-14(5)10-18(16)15-7-6-12(3)8-13(15)4/h11-17H,6-10H2,1-5H3
InChIKeyDRQQXXNTKIALJL-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-5-methyl-2-propan-2-ylpiperazine
CID 64954285
9-methyl-3-(5-methyl-2-propan-2-ylpiperazin-1-yl)-9-azabicyclo[3.3.1]nonane
CID 65471309
5-methyl-1-[(3-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine
CID 107415594
5-methyl-1-(4-methylsulfanylcyclohexyl)-2-propan-2-ylpiperazine
CID 114122816
5-methyl-1-(oxan-3-yl)-2-propan-2-ylpiperazine
CID 64937820
1-(2-methylcyclopentyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64941388
1-(2,4-dimethylcyclohexyl)-3-methylpiperazine
CID 64953434
3-(5-methyl-2-propan-2-ylpiperazin-1-yl)thiane 1,1-dioxide
CID 64938017
5-tert-butyl-1-(1,3-dimethylpiperidin-4-yl)-2-propan-2-ylpiperazine
CID 114506170
2-ethyl-5-methyl-1-(2-methylcyclobutyl)piperazine
CID 130556507
5-ethyl-1-(3-ethyl-2-methylcyclopentyl)-2-propan-2-ylpiperazine
CID 64940926
1-(3,4-dimethylcyclohexyl)-2,5-di(propan-2-yl)piperazine
CID 64936701

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine?
The IUPAC name of 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine (CID 64937246) is 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine?
The canonical SMILES for 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine is CC1CCC(N2CC(C)NCC2C(C)C)C(C)C1.
What is the InChIKey of 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine?
The InChIKey is DRQQXXNTKIALJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-11(2)16-9-17-14(5)10-18(16)15-7-6-12(3)8-13(15)4/h11-17H,6-10H2,1-5H3.
What are the key properties of 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine?
1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylcyclohexyl)-5-methyl-2-propan-2-ylpiperazine is sourced from PubChem (CID 64937246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).