(4-methylmorpholin-3-yl)-piperazin-1-ylmethanone

C10H19N3O2 — CID 91595206

IUPAC(4-methylmorpholin-3-yl)-piperazin-1-ylmethanone
SMILESCN1CCOCC1C(=O)N1CCNCC1
InChIInChI=1S/C10H19N3O2/c1-12-6-7-15-8-9(12)10(14)13-4-2-11-3-5-13/h9,11H,2-8H2,1H3
InChIKeyWSTJDBQNNWWBRH-UHFFFAOYSA-N
MW213.28 g/mol
LogP-1.25
Rot. Bonds1

About (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone

(4-methylmorpholin-3-yl)-piperazin-1-ylmethanone (PubChem CID 91595206) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone.

Molecular Properties

Compound Name(4-methylmorpholin-3-yl)-piperazin-1-ylmethanone
PubChem CID91595206
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name(4-methylmorpholin-3-yl)-piperazin-1-ylmethanone
SMILESCN1CCOCC1C(=O)N1CCNCC1
InChIInChI=1S/C10H19N3O2/c1-12-6-7-15-8-9(12)10(14)13-4-2-11-3-5-13/h9,11H,2-8H2,1H3
InChIKeyWSTJDBQNNWWBRH-UHFFFAOYSA-N
XLogP-1.25
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-1.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone?
The IUPAC name of (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone (CID 91595206) is (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone.
What is the SMILES notation for (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone?
The canonical SMILES for (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone is CN1CCOCC1C(=O)N1CCNCC1.
What is the InChIKey of (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone?
The InChIKey is WSTJDBQNNWWBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-12-6-7-15-8-9(12)10(14)13-4-2-11-3-5-13/h9,11H,2-8H2,1H3.
What are the key properties of (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone?
(4-methylmorpholin-3-yl)-piperazin-1-ylmethanone has a molecular weight of 213.28 g/mol, XLogP of -1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylmorpholin-3-yl)-piperazin-1-ylmethanone is sourced from PubChem (CID 91595206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).