1-(3-methoxycyclobutyl)-4-methylpiperazine

C10H20N2O — CID 166077871

IUPAC1-(3-methoxycyclobutyl)-4-methylpiperazine
SMILESCOC1CC(N2CCN(C)CC2)C1
InChIInChI=1S/C10H20N2O/c1-11-3-5-12(6-4-11)9-7-10(8-9)13-2/h9-10H,3-8H2,1-2H3
InChIKeyGVCUCZTVGNGSRF-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.41
Rot. Bonds2

About 1-(3-methoxycyclobutyl)-4-methylpiperazine

1-(3-methoxycyclobutyl)-4-methylpiperazine (PubChem CID 166077871) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(3-methoxycyclobutyl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(3-methoxycyclobutyl)-4-methylpiperazine
PubChem CID166077871
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-(3-methoxycyclobutyl)-4-methylpiperazine
SMILESCOC1CC(N2CCN(C)CC2)C1
InChIInChI=1S/C10H20N2O/c1-11-3-5-12(6-4-11)9-7-10(8-9)13-2/h9-10H,3-8H2,1-2H3
InChIKeyGVCUCZTVGNGSRF-UHFFFAOYSA-N
XLogP0.41
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxycyclobutyl)-4-methylpiperazine?
The IUPAC name of 1-(3-methoxycyclobutyl)-4-methylpiperazine (CID 166077871) is 1-(3-methoxycyclobutyl)-4-methylpiperazine.
What is the SMILES notation for 1-(3-methoxycyclobutyl)-4-methylpiperazine?
The canonical SMILES for 1-(3-methoxycyclobutyl)-4-methylpiperazine is COC1CC(N2CCN(C)CC2)C1.
What is the InChIKey of 1-(3-methoxycyclobutyl)-4-methylpiperazine?
The InChIKey is GVCUCZTVGNGSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-11-3-5-12(6-4-11)9-7-10(8-9)13-2/h9-10H,3-8H2,1-2H3.
What are the key properties of 1-(3-methoxycyclobutyl)-4-methylpiperazine?
1-(3-methoxycyclobutyl)-4-methylpiperazine has a molecular weight of 184.28 g/mol, XLogP of 0.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxycyclobutyl)-4-methylpiperazine is sourced from PubChem (CID 166077871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).