4-methyl-3-(piperazin-1-ylmethyl)morpholine

C10H21N3O — CID 23079676

IUPAC4-methyl-3-(piperazin-1-ylmethyl)morpholine
SMILESCN1CCOCC1CN1CCNCC1
InChIInChI=1S/C10H21N3O/c1-12-6-7-14-9-10(12)8-13-4-2-11-3-5-13/h10-11H,2-9H2,1H3
InChIKeyDGFLPLXPQZLHAG-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.78
Rot. Bonds2

About 4-methyl-3-(piperazin-1-ylmethyl)morpholine

4-methyl-3-(piperazin-1-ylmethyl)morpholine (PubChem CID 23079676) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 4-methyl-3-(piperazin-1-ylmethyl)morpholine.

Molecular Properties

Compound Name4-methyl-3-(piperazin-1-ylmethyl)morpholine
PubChem CID23079676
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name4-methyl-3-(piperazin-1-ylmethyl)morpholine
SMILESCN1CCOCC1CN1CCNCC1
InChIInChI=1S/C10H21N3O/c1-12-6-7-14-9-10(12)8-13-4-2-11-3-5-13/h10-11H,2-9H2,1H3
InChIKeyDGFLPLXPQZLHAG-UHFFFAOYSA-N
XLogP-0.78
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(piperazin-1-ylmethyl)morpholine?
The IUPAC name of 4-methyl-3-(piperazin-1-ylmethyl)morpholine (CID 23079676) is 4-methyl-3-(piperazin-1-ylmethyl)morpholine.
What is the SMILES notation for 4-methyl-3-(piperazin-1-ylmethyl)morpholine?
The canonical SMILES for 4-methyl-3-(piperazin-1-ylmethyl)morpholine is CN1CCOCC1CN1CCNCC1.
What is the InChIKey of 4-methyl-3-(piperazin-1-ylmethyl)morpholine?
The InChIKey is DGFLPLXPQZLHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-12-6-7-14-9-10(12)8-13-4-2-11-3-5-13/h10-11H,2-9H2,1H3.
What are the key properties of 4-methyl-3-(piperazin-1-ylmethyl)morpholine?
4-methyl-3-(piperazin-1-ylmethyl)morpholine has a molecular weight of 199.30 g/mol, XLogP of -0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(piperazin-1-ylmethyl)morpholine is sourced from PubChem (CID 23079676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).