3-ethyl-1-(4-methoxybutan-2-yl)piperazine

C11H24N2O — CID 64953453

IUPAC3-ethyl-1-(4-methoxybutan-2-yl)piperazine
SMILESCCC1CN(C(C)CCOC)CCN1
InChIInChI=1S/C11H24N2O/c1-4-11-9-13(7-6-12-11)10(2)5-8-14-3/h10-12H,4-9H2,1-3H3
InChIKeyPGBOVPXCRZJYQZ-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.10
Rot. Bonds5

About 3-ethyl-1-(4-methoxybutan-2-yl)piperazine

3-ethyl-1-(4-methoxybutan-2-yl)piperazine (PubChem CID 64953453) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-ethyl-1-(4-methoxybutan-2-yl)piperazine.

Molecular Properties

Compound Name3-ethyl-1-(4-methoxybutan-2-yl)piperazine
PubChem CID64953453
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name3-ethyl-1-(4-methoxybutan-2-yl)piperazine
SMILESCCC1CN(C(C)CCOC)CCN1
InChIInChI=1S/C11H24N2O/c1-4-11-9-13(7-6-12-11)10(2)5-8-14-3/h10-12H,4-9H2,1-3H3
InChIKeyPGBOVPXCRZJYQZ-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-tert-butyl-1-(4-methoxybutan-2-yl)piperazine
CID 64953254
3-ethyl-1-(2-methylpentan-3-yl)piperazine
CID 64925321
1-but-3-yn-2-yl-3-ethylpiperazine
CID 114420428
3-ethyl-1-(6-methylheptan-2-yl)-1,4-diazepane
CID 64945203
3-ethyl-1-(4-methylpentan-2-yl)-1,4-diazepane
CID 64944715
1-heptan-2-yl-3-propylpiperazine
CID 64924539
3-ethyl-1-(1-methylsulfonylpropan-2-yl)-1,4-diazepane
CID 64950632
3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine
CID 64924459
4-(1-chloroethyl)-1-(4-methoxybutan-2-yl)piperidine
CID 106838031
ethane;1-(4-methoxybutan-2-yl)-3-methylazetidine
CID 145168656
1-(4-methoxybutan-2-yl)-4-methylpiperidin-3-ol
CID 103898067
N-ethyl-1-(4-methoxybutan-2-yl)piperidin-3-amine
CID 64605963

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(4-methoxybutan-2-yl)piperazine?
The IUPAC name of 3-ethyl-1-(4-methoxybutan-2-yl)piperazine (CID 64953453) is 3-ethyl-1-(4-methoxybutan-2-yl)piperazine.
What is the SMILES notation for 3-ethyl-1-(4-methoxybutan-2-yl)piperazine?
The canonical SMILES for 3-ethyl-1-(4-methoxybutan-2-yl)piperazine is CCC1CN(C(C)CCOC)CCN1.
What is the InChIKey of 3-ethyl-1-(4-methoxybutan-2-yl)piperazine?
The InChIKey is PGBOVPXCRZJYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-11-9-13(7-6-12-11)10(2)5-8-14-3/h10-12H,4-9H2,1-3H3.
What are the key properties of 3-ethyl-1-(4-methoxybutan-2-yl)piperazine?
3-ethyl-1-(4-methoxybutan-2-yl)piperazine has a molecular weight of 200.33 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(4-methoxybutan-2-yl)piperazine is sourced from PubChem (CID 64953453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).