5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine

C17H34N2 — CID 64876359

IUPAC5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine
SMILESCCC1(C)CNC(C)(C2CC2)CN1CCC(C)(C)C
InChIInChI=1S/C17H34N2/c1-7-16(5)12-18-17(6,14-8-9-14)13-19(16)11-10-15(2,3)4/h14,18H,7-13H2,1-6H3
InChIKeyHDOHKNNNVUJPTQ-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds4

About 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine

5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine (PubChem CID 64876359) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine
PubChem CID64876359
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine
SMILESCCC1(C)CNC(C)(C2CC2)CN1CCC(C)(C)C
InChIInChI=1S/C17H34N2/c1-7-16(5)12-18-17(6,14-8-9-14)13-19(16)11-10-15(2,3)4/h14,18H,7-13H2,1-6H3
InChIKeyHDOHKNNNVUJPTQ-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(E)-but-2-enyl]-5-cyclopropyl-2-ethyl-2,5-dimethylpiperazine
CID 107898082
5-cyclopropyl-2,2,5-trimethyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64876752
5-cyclopropyl-2-ethyl-2,5-dimethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64878294
1-[(4-bromophenyl)methyl]-5-cyclopropyl-2-ethyl-2,5-dimethylpiperazine
CID 64875981
5-cyclopropyl-2-ethyl-2,5-dimethyl-1-(pyridin-4-ylmethyl)piperazine
CID 64878482
5-cyclopropyl-2-ethyl-2,5-dimethyl-1-(thiophen-2-ylmethyl)piperazine
CID 64876360
1-cycloheptyl-5-cyclopropyl-2-ethyl-2,5-dimethylpiperazine
CID 82936095
5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine
CID 80697138
1-butan-2-yl-5-cyclopropyl-2-ethyl-2,5-dimethylpiperazine
CID 79445840
5-cyclopropyl-2,2-diethyl-1,5-dimethylpiperazine
CID 64860018
2,5-dicyclopropyl-1-ethyl-2,5-dimethylpiperazine
CID 64859833
5-cyclopropyl-1-(3-ethoxypropyl)-2,2-diethyl-5-methylpiperazine
CID 65177697

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine?
The IUPAC name of 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine (CID 64876359) is 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine.
What is the SMILES notation for 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine?
The canonical SMILES for 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine is CCC1(C)CNC(C)(C2CC2)CN1CCC(C)(C)C.
What is the InChIKey of 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine?
The InChIKey is HDOHKNNNVUJPTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-7-16(5)12-18-17(6,14-8-9-14)13-19(16)11-10-15(2,3)4/h14,18H,7-13H2,1-6H3.
What are the key properties of 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine?
5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine is sourced from PubChem (CID 64876359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).