1-butyl-5-cyclohexyl-2,2-dimethylpiperazine

C16H32N2 — CID 64861711

IUPAC1-butyl-5-cyclohexyl-2,2-dimethylpiperazine
SMILESCCCCN1CC(C2CCCCC2)NCC1(C)C
InChIInChI=1S/C16H32N2/c1-4-5-11-18-12-15(17-13-16(18,2)3)14-9-7-6-8-10-14/h14-15,17H,4-13H2,1-3H3
InChIKeyUFQBEANUYIZUIA-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds4

About 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine

1-butyl-5-cyclohexyl-2,2-dimethylpiperazine (PubChem CID 64861711) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine.

Molecular Properties

Compound Name1-butyl-5-cyclohexyl-2,2-dimethylpiperazine
PubChem CID64861711
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-butyl-5-cyclohexyl-2,2-dimethylpiperazine
SMILESCCCCN1CC(C2CCCCC2)NCC1(C)C
InChIInChI=1S/C16H32N2/c1-4-5-11-18-12-15(17-13-16(18,2)3)14-9-7-6-8-10-14/h14-15,17H,4-13H2,1-3H3
InChIKeyUFQBEANUYIZUIA-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclohexyl-1-hexyl-2,2-dimethylpiperazine
CID 64861163
1-butyl-5-cyclohexyl-2,2-diethylpiperazine
CID 64861362
5-cyclohexyl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64861713
5-cyclohexyl-2,2-dimethyl-1-[2-(trifluoromethylsulfanyl)ethyl]piperazine
CID 116627571
2,2,5-trimethyl-1-pentylpiperazine
CID 64845904
5-cyclopropyl-2-ethyl-2-methyl-1-octylpiperazine
CID 64860145
5-ethyl-2,2-dimethyl-1-pentylpiperazine
CID 64843523
5-cyclopropyl-1-(3-imidazol-1-ylpropyl)-2,2-dimethylpiperazine
CID 64862252
5-cyclohexyl-2,2-dimethyl-1-(thiophen-2-ylmethyl)piperazine
CID 64861167
5-cyclopropyl-1,2,2-trimethylpiperazine
CID 64860529
5-cyclopropyl-2-ethyl-2-methyl-1-propylpiperazine
CID 64862262
5-cyclopropyl-2,2-dimethyl-1-(2-propan-2-ylsulfonylethyl)piperazine
CID 106733291

Frequently Asked Questions

What is the IUPAC name of 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine?
The IUPAC name of 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine (CID 64861711) is 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine.
What is the SMILES notation for 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine?
The canonical SMILES for 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine is CCCCN1CC(C2CCCCC2)NCC1(C)C.
What is the InChIKey of 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine?
The InChIKey is UFQBEANUYIZUIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-4-5-11-18-12-15(17-13-16(18,2)3)14-9-7-6-8-10-14/h14-15,17H,4-13H2,1-3H3.
What are the key properties of 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine?
1-butyl-5-cyclohexyl-2,2-dimethylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-5-cyclohexyl-2,2-dimethylpiperazine is sourced from PubChem (CID 64861711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).