2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine

C16H33N3O — CID 123755933

IUPAC2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine
SMILESCC1CN(C(C)C)CC(CCC2CN(C)CC(C)O2)N1
InChIInChI=1S/C16H33N3O/c1-12(2)19-8-13(3)17-15(10-19)6-7-16-11-18(5)9-14(4)20-16/h12-17H,6-11H2,1-5H3
InChIKeyPCVJPSUTWXIIMA-UHFFFAOYSA-N
MW283.46 g/mol
LogP1.56
Rot. Bonds4

About 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine

2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine (PubChem CID 123755933) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine.

Molecular Properties

Compound Name2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine
PubChem CID123755933
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine
SMILESCC1CN(C(C)C)CC(CCC2CN(C)CC(C)O2)N1
InChIInChI=1S/C16H33N3O/c1-12(2)19-8-13(3)17-15(10-19)6-7-16-11-18(5)9-14(4)20-16/h12-17H,6-11H2,1-5H3
InChIKeyPCVJPSUTWXIIMA-UHFFFAOYSA-N
XLogP1.56
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine?
The IUPAC name of 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine (CID 123755933) is 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine.
What is the SMILES notation for 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine?
The canonical SMILES for 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine is CC1CN(C(C)C)CC(CCC2CN(C)CC(C)O2)N1.
What is the InChIKey of 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine?
The InChIKey is PCVJPSUTWXIIMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-12(2)19-8-13(3)17-15(10-19)6-7-16-11-18(5)9-14(4)20-16/h12-17H,6-11H2,1-5H3.
What are the key properties of 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine?
2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine has a molecular weight of 283.46 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-[2-(6-methyl-4-propan-2-ylpiperazin-2-yl)ethyl]morpholine is sourced from PubChem (CID 123755933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).