3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one

C11H23N3O2 — CID 62542594

IUPAC3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one
SMILESCOCCN(C)CCC(=O)N1CCNCC1
InChIInChI=1S/C11H23N3O2/c1-13(9-10-16-2)6-3-11(15)14-7-4-12-5-8-14/h12H,3-10H2,1-2H3
InChIKeyFZYANTTVRTXRKB-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.61
Rot. Bonds6

About 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one

3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one (PubChem CID 62542594) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one.

Molecular Properties

Compound Name3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one
PubChem CID62542594
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one
SMILESCOCCN(C)CCC(=O)N1CCNCC1
InChIInChI=1S/C11H23N3O2/c1-13(9-10-16-2)6-3-11(15)14-7-4-12-5-8-14/h12H,3-10H2,1-2H3
InChIKeyFZYANTTVRTXRKB-UHFFFAOYSA-N
XLogP-0.61
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-methoxypropyl(methyl)amino]-1-piperazin-1-ylpropan-1-one
CID 62985898
4-[bis(2-methoxyethyl)amino]-1-piperazin-1-ylbutan-1-one
CID 39286712
3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-piperazin-1-ylpropan-1-one
CID 163402844
3-[3-(2-methoxyethoxy)propoxy]-1-piperazin-1-ylpropan-1-one
CID 103402655
N-(3-methoxypropyl)-N-methylpiperazine-1-carboxamide
CID 62983933
N-(2-methoxyethyl)-4-methyl-N-(3-oxo-3-piperazin-1-ylpropyl)benzamide
CID 50779269
4-bromo-N-(2-methoxyethyl)-N-(3-oxo-3-piperazin-1-ylpropyl)benzamide
CID 50779430
3-[methyl-[(2-methylcyclopropyl)methyl]amino]-1-piperazin-1-ylpropan-1-one
CID 63864805
3-[bis(2-ethoxyethyl)amino]-1-piperazin-1-ylpropan-1-one
CID 82960429
3-[2-cyclohexylethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one;hydrochloride
CID 120981404
3-(dipropylamino)-1-piperazin-1-ylpropan-1-one
CID 39255849
N-(2-methoxyethyl)-N-(3-oxo-3-piperazin-1-ylpropyl)-4-(trifluoromethyl)benzamide
CID 50779268

Frequently Asked Questions

What is the IUPAC name of 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one?
The IUPAC name of 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one (CID 62542594) is 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one.
What is the SMILES notation for 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one?
The canonical SMILES for 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one is COCCN(C)CCC(=O)N1CCNCC1.
What is the InChIKey of 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one?
The InChIKey is FZYANTTVRTXRKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-13(9-10-16-2)6-3-11(15)14-7-4-12-5-8-14/h12H,3-10H2,1-2H3.
What are the key properties of 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one?
3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one has a molecular weight of 229.32 g/mol, XLogP of -0.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-methoxyethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one is sourced from PubChem (CID 62542594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).