1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine

C11H21BrN2 — CID 64978694

IUPAC1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine
SMILESC=C(Br)CN1CC(CC)NCC1CC
InChIInChI=1S/C11H21BrN2/c1-4-10-8-14(7-9(3)12)11(5-2)6-13-10/h10-11,13H,3-8H2,1-2H3
InChIKeyMRKAEOUBOJONNT-UHFFFAOYSA-N
MW261.21 g/mol
LogP2.36
Rot. Bonds4

About 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine

1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine (PubChem CID 64978694) has the molecular formula C11H21BrN2 and a molecular weight of 261.21 g/mol. Its IUPAC name is 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine.

Molecular Properties

Compound Name1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine
PubChem CID64978694
Molecular FormulaC11H21BrN2
Molecular Weight261.21 g/mol
Exact Mass260.09
IUPAC Name1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine
SMILESC=C(Br)CN1CC(CC)NCC1CC
InChIInChI=1S/C11H21BrN2/c1-4-10-8-14(7-9(3)12)11(5-2)6-13-10/h10-11,13H,3-8H2,1-2H3
InChIKeyMRKAEOUBOJONNT-UHFFFAOYSA-N
XLogP2.36
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.21
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-chloro-2-methylprop-2-enyl)-2,5-diethylpiperazine
CID 106439468
2-(2,5-diethylpiperazin-1-yl)-N,N-dipropylacetamide
CID 64978870
2-(2,5-diethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone
CID 64979180
2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone
CID 64979235
4-(2,5-diethylpiperazin-1-yl)-2-methylbutan-2-ol
CID 79355714
3-(2,5-diethylpiperazin-1-yl)propanoic acid
CID 64978721
1-(cyclopentylmethyl)-2,5-diethylpiperazine
CID 64843856
2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide
CID 64979203
2-(2,5-diethylpiperazin-1-yl)-1-(3-methylpiperidin-1-yl)ethanone
CID 64978777
N-(2-bromophenyl)-2-(2,5-diethylpiperazin-1-yl)acetamide
CID 64978706
2,5-diethyl-1-(3-methylsulfanylpropyl)piperazine
CID 64942402
2-(2,5-diethylpiperazin-1-yl)-N-(3-ethylpent-1-yn-3-yl)acetamide
CID 64979190

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine?
The IUPAC name of 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine (CID 64978694) is 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine.
What is the SMILES notation for 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine?
The canonical SMILES for 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine is C=C(Br)CN1CC(CC)NCC1CC.
What is the InChIKey of 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine?
The InChIKey is MRKAEOUBOJONNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21BrN2/c1-4-10-8-14(7-9(3)12)11(5-2)6-13-10/h10-11,13H,3-8H2,1-2H3.
What are the key properties of 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine?
1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine has a molecular weight of 261.21 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine is sourced from PubChem (CID 64978694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).