1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine

C19H42N4 — CID 165044772

IUPAC1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine
SMILESCC(C)CN1CCN(C)CC1.CCN1CCN(CC(C)C)CC1
InChIInChI=1S/C10H22N2.C9H20N2/c1-4-11-5-7-12(8-6-11)9-10(2)3;1-9(2)8-11-6-4-10(3)5-7-11/h10H,4-9H2,1-3H3;9H,4-8H2,1-3H3
InChIKeyOSFIMCFZFVNDLX-UHFFFAOYSA-N
MW326.57 g/mol
LogP2.17
Rot. Bonds5

About 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine

1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine (PubChem CID 165044772) has the molecular formula C19H42N4 and a molecular weight of 326.57 g/mol. Its IUPAC name is 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine
PubChem CID165044772
Molecular FormulaC19H42N4
Molecular Weight326.57 g/mol
Exact Mass326.34
IUPAC Name1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine
SMILESCC(C)CN1CCN(C)CC1.CCN1CCN(CC(C)C)CC1
InChIInChI=1S/C10H22N2.C9H20N2/c1-4-11-5-7-12(8-6-11)9-10(2)3;1-9(2)8-11-6-4-10(3)5-7-11/h10H,4-9H2,1-3H3;9H,4-8H2,1-3H3
InChIKeyOSFIMCFZFVNDLX-UHFFFAOYSA-N
XLogP2.17
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.57
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-4,7-dimethyl-10-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane
CID 118545612
1-methyl-4-(2-methylpropyl)piperazine
CID 20562082
1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine
CID 160568928
1-methyl-4-(2-methylpropyl)-1,4-diazepane
CID 58719890
1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
CID 82084531
butane;1-ethyl-4-methylpiperazine
CID 143179774
ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
CID 170586549
ethane;1-ethyl-4-methylpiperazine;methanethiol
CID 142272147
1-methyl-4-[(2S)-2-methylbutyl]piperazine
CID 130224614
1-[3-(1-ethylpiperidin-4-yl)propyl]-4-(2-methylpropyl)piperazine
CID 156885442
acetaldehyde;1-ethyl-4-methylpiperazine
CID 143528036
1-(1-ethylazetidin-3-yl)-4-(2-methylpropyl)piperazine
CID 156885108

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine?
The IUPAC name of 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine (CID 165044772) is 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine?
The canonical SMILES for 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine is CC(C)CN1CCN(C)CC1.CCN1CCN(CC(C)C)CC1.
What is the InChIKey of 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine?
The InChIKey is OSFIMCFZFVNDLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2.C9H20N2/c1-4-11-5-7-12(8-6-11)9-10(2)3;1-9(2)8-11-6-4-10(3)5-7-11/h10H,4-9H2,1-3H3;9H,4-8H2,1-3H3.
What are the key properties of 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine?
1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine has a molecular weight of 326.57 g/mol, XLogP of 2.17, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine is sourced from PubChem (CID 165044772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).