(3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone

C11H21N3O2 — CID 110869147

IUPAC(3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone
SMILESCC1CN(C(=O)N2CCOCC2)CCN1C
InChIInChI=1S/C11H21N3O2/c1-10-9-14(4-3-12(10)2)11(15)13-5-7-16-8-6-13/h10H,3-9H2,1-2H3
InChIKeyJQMZROIAMVMCQX-UHFFFAOYSA-N
MW227.31 g/mol
LogP0.07
Rot. Bonds

About (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone

(3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone (PubChem CID 110869147) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone
PubChem CID110869147
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name(3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone
SMILESCC1CN(C(=O)N2CCOCC2)CCN1C
InChIInChI=1S/C11H21N3O2/c1-10-9-14(4-3-12(10)2)11(15)13-5-7-16-8-6-13/h10H,3-9H2,1-2H3
InChIKeyJQMZROIAMVMCQX-UHFFFAOYSA-N
XLogP0.07
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone?
The IUPAC name of (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone (CID 110869147) is (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone is CC1CN(C(=O)N2CCOCC2)CCN1C.
What is the InChIKey of (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone?
The InChIKey is JQMZROIAMVMCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-10-9-14(4-3-12(10)2)11(15)13-5-7-16-8-6-13/h10H,3-9H2,1-2H3.
What are the key properties of (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone?
(3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone has a molecular weight of 227.31 g/mol, XLogP of 0.07, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylpiperazin-1-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 110869147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).