2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine

C16H32N2 — CID 114013068

IUPAC2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine
SMILESCCCC(C)N1CC(C2CC2)NCC1C(C)CC
InChIInChI=1S/C16H32N2/c1-5-7-13(4)18-11-15(14-8-9-14)17-10-16(18)12(3)6-2/h12-17H,5-11H2,1-4H3
InChIKeyGLMPPTCTXGVVQH-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.27
Rot. Bonds6

About 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine

2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine (PubChem CID 114013068) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine.

Molecular Properties

Compound Name2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine
PubChem CID114013068
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine
SMILESCCCC(C)N1CC(C2CC2)NCC1C(C)CC
InChIInChI=1S/C16H32N2/c1-5-7-13(4)18-11-15(14-8-9-14)17-10-16(18)12(3)6-2/h12-17H,5-11H2,1-4H3
InChIKeyGLMPPTCTXGVVQH-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butan-2-yl-5-cyclopropyl-1-propan-2-ylpiperazine
CID 64860502
2-butan-2-yl-5-ethyl-1-pentan-2-ylpiperazine
CID 114013055
2-butan-2-yl-5-cyclopropyl-1-(2-propoxyethyl)piperazine
CID 106458816
2-butan-2-yl-5-cyclopropyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64862422
5-cyclopropyl-1-(3-methylpentan-2-yl)-2-propan-2-ylpiperazine
CID 64934402
5-cyclopropyl-1-(1-methoxypropan-2-yl)-2-propan-2-ylpiperazine
CID 64932375
2-butan-2-yl-5-cyclopropyl-1-[(1-methyltriazol-4-yl)methyl]piperazine
CID 107056103
5-butan-2-yl-2-cyclopropyl-1-pentan-2-ylpiperazine
CID 114013061
2-butan-2-yl-5-cyclopropyl-1-(3-methoxypropyl)piperazine
CID 64862424
1-(2-bicyclo[2.2.1]heptanylmethyl)-2-butan-2-yl-5-cyclopropylpiperazine
CID 79559332
2-butan-2-yl-5-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]piperazine
CID 64861848
2-butan-2-yl-5-cyclopropyl-1-(oxolan-3-ylmethyl)piperazine
CID 64859732

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine?
The IUPAC name of 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine (CID 114013068) is 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine.
What is the SMILES notation for 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine?
The canonical SMILES for 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine is CCCC(C)N1CC(C2CC2)NCC1C(C)CC.
What is the InChIKey of 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine?
The InChIKey is GLMPPTCTXGVVQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-5-7-13(4)18-11-15(14-8-9-14)17-10-16(18)12(3)6-2/h12-17H,5-11H2,1-4H3.
What are the key properties of 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine?
2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-5-cyclopropyl-1-pentan-2-ylpiperazine is sourced from PubChem (CID 114013068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).