2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine

C16H30N2O — CID 106458819

IUPAC2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine
SMILESCC(C)COCCN1CC(C2CC2)NCC1C1CC1
InChIInChI=1S/C16H30N2O/c1-12(2)11-19-8-7-18-10-15(13-3-4-13)17-9-16(18)14-5-6-14/h12-17H,3-11H2,1-2H3
InChIKeyVNOHJWMSFXSZFN-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.12
Rot. Bonds7

About 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine

2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine (PubChem CID 106458819) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine.

Molecular Properties

Compound Name2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine
PubChem CID106458819
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine
SMILESCC(C)COCCN1CC(C2CC2)NCC1C1CC1
InChIInChI=1S/C16H30N2O/c1-12(2)11-19-8-7-18-10-15(13-3-4-13)17-9-16(18)14-5-6-14/h12-17H,3-11H2,1-2H3
InChIKeyVNOHJWMSFXSZFN-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-cyclohexyl-5-methyl-1-[2-(2-methylpropoxy)ethyl]piperazine
CID 106458521
2,5-dicyclopropyl-1-pentylpiperazine
CID 64859934
2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine
CID 64849325
2-cyclohexyl-1-[2-(2-methylpropoxy)ethyl]piperazine
CID 106458501
2,5-dicyclopropyl-1-(2-methylsulfonylethyl)piperazine
CID 64861284
1-butyl-2-cyclohexyl-5-cyclopropylpiperazine
CID 64861672
2-butan-2-yl-5-cyclopropyl-1-(2-propoxyethyl)piperazine
CID 106458816
2-cyclohexyl-5-cyclopropyl-1-(4-methoxybutyl)piperazine
CID 104650306
2-butan-2-yl-5-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]piperazine
CID 64861848
3-cyclopropyl-7-methyl-1-[2-(3-methylbutoxy)ethyl]-1,4-diazepane
CID 64871414
5-tert-butyl-2-cyclopropyl-1-(2-ethoxyethyl)piperazine
CID 64841456
2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine
CID 64845102

Frequently Asked Questions

What is the IUPAC name of 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine?
The IUPAC name of 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine (CID 106458819) is 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine.
What is the SMILES notation for 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine?
The canonical SMILES for 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine is CC(C)COCCN1CC(C2CC2)NCC1C1CC1.
What is the InChIKey of 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine?
The InChIKey is VNOHJWMSFXSZFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-12(2)11-19-8-7-18-10-15(13-3-4-13)17-9-16(18)14-5-6-14/h12-17H,3-11H2,1-2H3.
What are the key properties of 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine?
2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine has a molecular weight of 266.43 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine is sourced from PubChem (CID 106458819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).