1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride

C11H23Cl2N3O2 — CID 50988307

IUPAC1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride
SMILESCC(C(=O)N1CCOCC1)N1CCNCC1.Cl.Cl
InChIInChI=1S/C11H21N3O2.2ClH/c1-10(13-4-2-12-3-5-13)11(15)14-6-8-16-9-7-14;;/h10,12H,2-9H2,1H3;2*1H
InChIKeyRSINAHBERGLYPN-UHFFFAOYSA-N
MW300.23 g/mol
LogP-0.02
Rot. Bonds2

About 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride

1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride (PubChem CID 50988307) has the molecular formula C11H23Cl2N3O2 and a molecular weight of 300.23 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride.

Molecular Properties

Compound Name1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride
PubChem CID50988307
Molecular FormulaC11H23Cl2N3O2
Molecular Weight300.23 g/mol
Exact Mass299.12
IUPAC Name1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride
SMILESCC(C(=O)N1CCOCC1)N1CCNCC1.Cl.Cl
InChIInChI=1S/C11H21N3O2.2ClH/c1-10(13-4-2-12-3-5-13)11(15)14-6-8-16-9-7-14;;/h10,12H,2-9H2,1H3;2*1H
InChIKeyRSINAHBERGLYPN-UHFFFAOYSA-N
XLogP-0.02
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.23
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-morpholin-4-yl-2-(3-piperazin-1-ylazetidin-1-yl)propan-1-one
CID 66197711
2,3-dimethyl-1-morpholin-4-yl-4-piperazin-1-ylbutane-1,4-dione
CID 173096762
1-(azepan-1-yl)-2-(1,4-diazepan-1-yl)propan-1-one;hydrochloride
CID 119925291
2-(4-hydroxypiperidin-1-yl)-1-morpholin-4-ylpropan-1-one
CID 60638552
2-[4-[(3-methylpyrrolidin-3-yl)methyl]piperazin-1-yl]-1-morpholin-4-ylpropan-1-one;hydrochloride
CID 120899942
2-(3,5-dimethylpiperazin-1-yl)-1-morpholin-4-ylpropan-1-one
CID 63874452
1-morpholin-4-yl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propan-1-one;dihydrochloride
CID 119877474
1-(3,5-dimethylpiperidin-1-yl)-2-piperazin-1-ylpropan-1-one
CID 43130716
1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-piperazin-1-ylpropan-1-one
CID 43592282
N-methyl-4-(2-piperazin-1-ylpropanoyl)morpholine-3-carboxamide
CID 83103255
2-[4-(4-fluorophenyl)piperazin-1-yl]-1-morpholin-4-ylpropan-1-one
CID 78786208
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-1-morpholin-4-ylpropan-1-one
CID 46614351

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride?
The IUPAC name of 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride (CID 50988307) is 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride.
What is the SMILES notation for 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride?
The canonical SMILES for 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride is CC(C(=O)N1CCOCC1)N1CCNCC1.Cl.Cl.
What is the InChIKey of 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride?
The InChIKey is RSINAHBERGLYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2.2ClH/c1-10(13-4-2-12-3-5-13)11(15)14-6-8-16-9-7-14;;/h10,12H,2-9H2,1H3;2*1H.
What are the key properties of 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride?
1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride has a molecular weight of 300.23 g/mol, XLogP of -0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride is sourced from PubChem (CID 50988307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).